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Search results for: '899900-52-8'
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(R)-2-(diMethylaMino)-3-Methylbutanoic acid
Cas Number: 899900-52-8Formula: C7H15NO2Molecular weight: 145.1995SMILES: CC(C)C(C(=O)O)N(C)CInChIKey: APGLTERDKORUHK-ZCFIWIBFSA-NInChI: InChI=1S/C7H15NO2/c1-5(2)6(7(9)10)8(3)4/h5-6H,1-4H3,(H,9,10)/t6-/m1/s1
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4-fluoro-1-methylpiperidine-4-carboxylic acid
Cas Number: 1353498-52-8Formula: C7H12FNO2Molecular weight: 161.18Synonyms: 4-Fluoro-1-methylpiperidine-4-carboxylic acid | 1353498-52-8 | SCHEMBL12699863 | MFCD21090694 | AKOS...SMILES: CN1CCC(CC1)(C(=O)O)FInChIKey: FQCVRGQFNJITLF-UHFFFAOYSA-NInChI: InChI=1S/C7H12FNO2/c1-9-4-2-7(8,3-5-9)6(10)11/h2-5H2,1H3,(H,10,11)
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benzyl exo-3-(hydroxymethyl)-8-azabicyclo[3.2.1]octane-8-carboxylate
Cas Number: 1629128-52-4Formula: C16H21NO3Molecular weight: 275.34Synonyms: 1067230-68-5 | 1629128-52-4 | Benzyl 3-(hydroxymethyl)-8-azabicyclo[3.2.1]octane-8-carboxylate | N-C...SMILES: C1CC2CC(CC1N2C(=O)OCC3=CC=CC=C3)COInChIKey: BYTYNVIRGLRSME-GOOCMWNKSA-NInChI: InChI=1S/C16H21NO3/c18-10-13-8-14-6-7-15(9-13)17(14)16(19)20-11-12-4-2-1-3-5-12/h1-5,13-15,18H,6-11H2/t13?,14-,15+
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Methyl 4-hydroxy-8-(trifluoromethyl)quinoline-2-carboxylate
Cas Number: 1065074-52-3Formula: C12H8F3NO3Molecular weight: 271.2Synonyms: Methyl 4-hydroxy-8-(trifluoromethyl)quinoline-2-carboxylate|1065074-52-3|Methyl 4-oxo-8-(trifluorome...SMILES: COC(=O)C1=CC(=O)C2=C(N1)C(=CC=C2)C(F)(F)FInChIKey: YQFLSLNXTHQDHJ-UHFFFAOYSA-NInChI: InChI=1S/C12H8F3NO3/c1-19-11(18)8-5-9(17)6-3-2-4-7(10(6)16-8)12(13,14)15/h2-5H,1H3,(H,16,17)
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2,3-Dihydro-[1,4]dioxino[2,3-b]pyridin-8-amine
Cas Number: 1246088-52-7Formula: C7H8N2O2Molecular weight: 152.15Synonyms: 2,3-Dihydro-[1,4]dioxino[2,3-b]pyridin-8-amine, AldrichCPR | 1246088-52-7 | SCHEMBL3581102 | DTXSID0...SMILES: C1COC2=NC=CC(=C2O1)NInChIKey: JTNBYFVUXPHZIJ-UHFFFAOYSA-NInChI: InChI=1S/C7H8N2O2/c8-5-1-2-9-7-6(5)10-3-4-11-7/h1-2H,3-4H2,(H2,8,9)
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benzyl endo-3-(hydroxymethyl)-8-azabicyclo[3.2.1]octane-8-carboxylate
Cas Number: 1067230-68-5Formula: C16H21NO3Molecular weight: 275.34Synonyms: 1067230-68-5 | 1629128-52-4 | Benzyl 3-(hydroxymethyl)-8-azabicyclo[3.2.1]octane-8-carboxylate | N-C...SMILES: C1CC2CC(CC1N2C(=O)OCC3=CC=CC=C3)COInChIKey: BYTYNVIRGLRSME-GOOCMWNKSA-NInChI: InChI=1S/C16H21NO3/c18-10-13-8-14-6-7-15(9-13)17(14)16(19)20-11-12-4-2-1-3-5-12/h1-5,13-15,18H,6-11H2/t13?,14-,15+
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(1S,6R)-8-methyl-3,8-diazabicyclo[4.2.0]octane;dihydrochloride
Cas Number: 2221988-52-7Synonyms: 2221988-52-7 | (1S,6R)-8-methyl-3,8-diazabicyclo[4.2.0]octane dihydrochloride | (1s,6r)-8-methyl-3,8...SMILES: CN1CC2C1CNCC2.Cl.ClInChIKey: BAKUHFJICYNYRD-GPJOBVNKSA-NInChI: InChI=1S/C7H14N2.2ClH/c1-9-5-6-2-3-8-4-7(6)9;;/h6-8H,2-5H2,1H3;2*1H/t6-,7-;;/m1../s1
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Calix[8]arene
Cas Number: 82452-93-5Formula: C56H48O8Molecular weight: 848.98Synonyms: SCHEMBL12168748 | Calix(8)arene | MFCD00143914 | Calix[8]arene, technical, >=90% (CH) | W-203872 | n...SMILES: C1C2=C(C(=CC=C2)CC3=C(C(=CC=C3)CC4=C(C(=CC=C4)CC5=C(C(=CC=C5)CC6=CC=CC(=C6O)CC7=CC=CC(=C7O)CC8=CC=CC(=C8O)CC9=CC=CC1=C9O)O)O)O)OInChIKey: HDPRHRZFFPXZIL-UHFFFAOYSA-NInChI: See more
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2-Bromo-8-chloroquinoline
Cas Number: 891842-52-7Formula: C9H5BrClNMolecular weight: 242.5Synonyms: 2-BROMO-8-CHLOROQUINOLINE|891842-52-7|SCHEMBL3850693|DTXSID30682434|QSVCZJXVMARGOP-UHFFFAOYSA-N|MFCD...SMILES: C1=CC2=C(C(=C1)Cl)N=C(C=C2)BrInChIKey: QSVCZJXVMARGOP-UHFFFAOYSA-NInChI: InChI=1S/C9H5BrClN/c10-8-5-4-6-2-1-3-7(11)9(6)12-8/h1-5H
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Methyl 8-bromo-4-chloro-5-fluoroquinoline-2-carboxylate
Cas Number: 1133115-52-2Formula: C11H6BrClFNO2Molecular weight: 318.5Synonyms: 1133115-52-2 | AKOS015834726 | SB72537 | BS-23636 | MFCD11855872 | Methyl8-bromo-4-chloro-5-fluoroqu...SMILES: COC(=O)C1=NC2=C(C=CC(=C2C(=C1)Cl)F)BrInChIKey: YMMWGEUTLGBMQW-UHFFFAOYSA-NInChI: InChI=1S/C11H6BrClFNO2/c1-17-11(16)8-4-6(13)9-7(14)3-2-5(12)10(9)15-8/h2-4H,1H3
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LMP744
Cas Number: 308246-52-8Formula: C24H24N2O7Molecular weight: 452.5Synonyms: 308246-52-8 (free base) | Q27894415 | 20-[3-(2-Hydroxyethylamino)propyl]-15,16-dimethoxy-5,7-dioxa-2...SMILES: COC1=C(C=C2C(=C1)C3=C(C4=CC5=C(C=C4C3=O)OCO5)N(C2=O)CCCNCCO)OCInChIKey: QCSDJDQOJBQTDV-UHFFFAOYSA-NInChI: InChI=1S/C24H24N2O7/c1-30-17-8-13-16(11-18(17)31-2)24(29)26(6-3-4-25-5-7-27)22-14-9-19-20(33-12-32-19)10-15(14)23(28)21(13)22/h8-11,25,27H,3-7,12H2,1-2H3
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Trihexyphenidyl Hydrochloride, Muscarinic acetylcholine receptor M1 antagonist
Cas Number: 52-49-3Formula: C20H32ClNOMolecular weight: 337.927Synonyms: Trihexyphenidyl hydrochloride|Benzhexol hydrochloride|52-49-3|Artane|Trihexyphenidyl HCl|Parcopane|R...SMILES: C1CCC(CC1)C(CCN2CCCCC2)(C3=CC=CC=C3)O.ClInChIKey: QDWJJTJNXAKQKD-UHFFFAOYSA-NInChI: InChI=1S/C20H31NO.ClH/c22-20(18-10-4-1-5-11-18,19-12-6-2-7-13-19)14-17-21-15-8-3-9-16-21;/h1,4-5,10-11,19,22H,2-3,6-9,12-17H2;1H
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8-chloro-4-methyl-2H,3H,4H-pyridazino[4,5-b][1,4]oxazine
Cas Number: 66643-52-5Formula: C7H8ClN3OMolecular weight: 185.61Synonyms: 66643-52-5 | 8-CHLORO-3,4-DIHYDRO-4-METHYL-2H-PYRIDAZINO[4,5-B][1,4]OXAZINE | MFCD22417128 | 8-chlor...SMILES: CN1CCOC2=C(N=NC=C21)ClInChIKey: BLAZWSLDVGWXAP-UHFFFAOYSA-NInChI: InChI=1S/C7H8ClN3O/c1-11-2-3-12-6-5(11)4-9-10-7(6)8/h4H,2-3H2,1H3
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2,5-Dibromophenol
Cas Number: 28165-52-8Formula: C6H4Br2OMolecular weight: 251.9Synonyms: 2,5-DIBROMOPHENOL|28165-52-8|Phenol, 2,5-dibromo-|MFCD01851373|SCHEMBL582238|DTXSID40182430|GUXWVUVL...SMILES: C1=CC(=C(C=C1Br)O)BrInChIKey: GUXWVUVLXIJHQF-UHFFFAOYSA-NInChI: InChI=1S/C6H4Br2O/c7-4-1-2-5(8)6(9)3-4/h1-3,9H
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1-(4-bromophenyl)cyclopropane-1-carboxylic acid
Cas Number: 345965-52-8Formula: C10H9BrO2Molecular weight: 241.084Synonyms: 1-(4-Bromophenyl)cyclopropanecarboxylic acid|345965-52-8|1-(4-BROMOPHENYL)CYCLOPROPANE-1-CARBOXYLIC ...SMILES: C1CC1(C2=CC=C(C=C2)Br)C(=O)OInChIKey: BYJIXWOWTNEVFO-UHFFFAOYSA-NInChI: InChI=1S/C10H9BrO2/c11-8-3-1-7(2-4-8)10(5-6-10)9(12)13/h1-4H,5-6H2,(H,12,13)
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4-(Trifluoromethyl)anisole
Cas Number: 402-52-8Formula: C8H7F3OMolecular weight: 176.14Synonyms: 4-(Trifluoromethyl)anisole|402-52-8|1-methoxy-4-(trifluoromethyl)benzene|4-METHOXYBENZOTRIFLUORIDE|4...SMILES: COC1=CC=C(C=C1)C(F)(F)FInChIKey: CFIPQRIPCRRISV-UHFFFAOYSA-NInChI: InChI=1S/C8H7F3O/c1-12-7-4-2-6(3-5-7)8(9,10)11/h2-5H,1H3
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trans-4-(aminomethyl)-1-methyl-cyclohexanol;4-methylbenzenesulfonic acid
Cas Number: 1630101-52-8Formula: C8H17NO·CH2O3Molecular weight: 205.25Synonyms: 1630101-52-8 | (1r,4r)-4-(aminomethyl)-1-methylcyclohexanol 4-methylbenzenesulfonate | 4-(aminomethy...SMILES: CC1=CC=C(C=C1)S(=O)(=O)O.CC1(CCC(CC1)CN)OInChIKey: AEIHBQUSRNHJJC-UHFFFAOYSA-NInChI: InChI=1S/C8H17NO.C7H8O3S/c1-8(10)4-2-7(6-9)3-5-8;1-6-2-4-7(5-3-6)11(8,9)10/h7,10H,2-6,9H2,1H3;2-5H,1H3,(H,8,9,10)
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ETHYL ALPHA-CYANO-4-(DIMETHYLAMINO)CINNAMATE
Cas Number: 1886-52-8Formula: C14H16N2O2Molecular weight: 244.296Synonyms: 1886-52-8|ethyl 2-cyano-3-[4-(dimethylamino)phenyl]prop-2-enoate|2-Propenoic acid, 2-cyano-3-[4-(dim...SMILES: CCOC(=O)C(=CC1=CC=C(C=C1)N(C)C)C#NInChIKey: UWWFWHASAAPOLK-UHFFFAOYSA-NInChI: InChI=1S/C14H16N2O2/c1-4-18-14(17)12(10-15)9-11-5-7-13(8-6-11)16(2)3/h5-9H,4H2,1-3H3
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2,3,4,5-Tetrahydro-1H-1,5-methanobenzo[d]azepine hydrochloride
Cas Number: 230615-52-8Formula: C11H14ClNMolecular weight: 195.69Synonyms: 230615-52-8|2,3,4,5-Tetrahydro-1H-1,5-methanobenzo[d]azepine hydrochloride|2,3,4,5-Tetrahydro-1H-1,5...SMILES: C1C2CNCC1C3=CC=CC=C23.ClInChIKey: WWJDLIUDQHFAGC-UHFFFAOYSA-NInChI: InChI=1S/C11H13N.ClH/c1-2-4-11-9-5-8(6-12-7-9)10(11)3-1;/h1-4,8-9,12H,5-7H2;1H
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2-{[(tert-butoxy)carbonyl]amino}-2-(3,3-difluorocyclobutyl)acetic acid
Cas Number: 2097944-52-8 EC Number: 825-434-5Formula: C11H17F2NO4Molecular weight: 265.26Synonyms: SY344476 | MFCD31705706 | 2-((tert-butoxycarbonyl)amino)-2-(3,3-difluorocyclobutyl)acetic acid | 209...SMILES: CC(C)(C)OC(=O)NC(C1CC(C1)(F)F)C(=O)OInChIKey: BEYXDNVWKXTSEO-UHFFFAOYSA-NInChI: InChI=1S/C11H17F2NO4/c1-10(2,3)18-9(17)14-7(8(15)16)6-4-11(12,13)5-6/h6-7H,4-5H2,1-3H3,(H,14,17)(H,15,16)
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tert-butyl 4-trifluoromethylspiro[indoline-3,4'-piperidine]-1'-carboxylate
Cas Number: 1129421-52-8Formula: C18H23F3N2O2Molecular weight: 356.39Synonyms: 1129421-52-8 | tert-butyl 4-trifluoromethylspiro[indoline-3,4'-piperidine]-1'-carboxylate | Spiro[3H...SMILES: CC(C)(C)OC(=O)N1CCC2(CC1)CNC3=CC=CC(=C23)C(F)(F)FInChIKey: LZUATKFQCAMJLE-UHFFFAOYSA-NInChI: InChI=1S/C18H23F3N2O2/c1-16(2,3)25-15(24)23-9-7-17(8-10-23)11-22-13-6-4-5-12(14(13)17)18(19,20)21/h4-6,22H,7-11H2,1-3H3
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3-Chloro-1,2-benzisoxazole
Cas Number: 16263-52-8Formula: C7H4ClNOMolecular weight: 153.6Synonyms: 3-chloro-1,2-benzisoxazole|16263-52-8|3-chlorobenzo[d]isoxazole|3-chloro-1,2-benzoxazole|3-Chloro-1,...SMILES: C1=CC=C2C(=C1)C(=NO2)ClInChIKey: INWUFXPCLZRSBH-UHFFFAOYSA-NInChI: InChI=1S/C7H4ClNO/c8-7-5-3-1-2-4-6(5)10-9-7/h1-4H
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Lomefloxacin hydrochloride, Bacterial DNA gyrase inhibitor
Cas Number: 98079-52-8Formula: C17H19F2N3O3· HClMolecular weight: 387.81Synonyms: Lomefloxacin hydrochloride|98079-52-8|Lomefloxacin HCl|Maxaquin|Okacyn|Bareon|Ny-198|Mazaquin|Uniqui...SMILES: CCN1C=C(C(=O)C2=CC(=C(C(=C21)F)N3CCNC(C3)C)F)C(=O)O.ClInChIKey: KXEBLAPZMOQCKO-UHFFFAOYSA-NInChI: InChI=1S/C17H19F2N3O3.ClH/c1-3-21-8-11(17(24)25)16(23)10-6-12(18)15(13(19)14(10)21)22-5-4-20-9(2)7-22;/h6,8-9,20H,3-5,7H2,1-2H3,(H,24,25);1H
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Methyl 4-amino-2,5-difluorobenzoate
Cas Number: 952285-52-8Formula: C8H7F2NO2Molecular weight: 187.1Synonyms: METHYL 4-AMINO-2,5-DIFLUOROBENZOATE|952285-52-8|Benzoic acid, 4-aMino-2,5-difluoro-, Methyl ester|MF...SMILES: COC(=O)C1=CC(=C(C=C1F)N)FInChIKey: WFHMJOPCOWABHH-UHFFFAOYSA-NInChI: InChI=1S/C8H7F2NO2/c1-13-8(12)4-2-6(10)7(11)3-5(4)9/h2-3H,11H2,1H3
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