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Benzoxazepines
Description:
Organic compounds containing a benzene fused to an oxazepine ring (a seven-membered ring with four carbon atoms, one oxygen atom, and a nitrogen atom).
Ancestors:
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3，4-Dihydrobenzo[f][1，4]oxazepin-5(2H)-oneCas Number: 703-51-5 Compound CID: 340629Formula: C9H9NO2 Molecular Weight: 163.18IUPAC Name: 3,4-dihydro-2H-1,4-benzoxazepin-5-oneSMILES: C1COC2=CC=CC=C2C(=O)N1InChIKey: FGKQHXRVPDLTDF-UHFFFAOYSA-NInChI: InChI=1S/C9H9NO2/c11-9-7-3-1-2-4-8(7)12-6-5-10-9/h1-4H,5-6H2,(H,10,11) -
2，3，4，5-Tetrahydrobenzo[b][1，4]oxazepineFormula: C9H11NO Molecular Weight: 149.19IUPAC Name: 2,3,4,5-tetrahydro-1,5-benzoxazepineSMILES: C1CNC2=CC=CC=C2OC1InChIKey: HYLJXJSMGIOVIK-UHFFFAOYSA-NInChI: InChI=1S/C9H11NO/c1-2-5-9-8(4-1)10-6-3-7-11-9/h1-2,4-5,10H,3,6-7H2
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8-nitro-3,4-dihydro-2H-1,4-benzoxazepin-5-oneCas Number: 1022974-20-4 Compound CID: 57853781Formula: C9H8N2O4 Molecular Weight: 208.17SMILES: C1COC2=C(C=CC(=C2)[N+](=O)[O-])C(=O)N1InChIKey: UXBRMBQHYAHMLD-UHFFFAOYSA-NInChI: InChI=1S/C9H8N2O4/c12-9-7-2-1-6(11(13)14)5-8(7)15-4-3-10-9/h1-2,5H,3-4H2,(H,10,12) -
7-bromo-1,5-dihydro-4,1-benzoxazepin-2-oneCas Number: 886756-67-8 Compound CID: 74787774Formula: C9H8BrNO2 Molecular Weight: 242.07SMILES: C1C2=C(C=CC(=C2)Br)NC(=O)CO1InChIKey: WSNHVMZMIOFLKS-UHFFFAOYSA-NInChI: InChI=1S/C9H8BrNO2/c10-7-1-2-8-6(3-7)4-13-5-9(12)11-8/h1-3H,4-5H2,(H,11,12)
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PiclozotanCas Number: 182415-09-4 Compound CID: 9801640Formula: C23H24ClN3O2 Molecular Weight: 409.9IUPAC Name: 3-chloro-4-[4-(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)butyl]-1,4-benzoxazepin-5-oneSMILES: C1CN(CC=C1C2=CC=CC=N2)CCCCN3C(=COC4=CC=CC=C4C3=O)ClInChIKey: URMTUEWUIGOJBW-UHFFFAOYSA-NInChI: InChI=1S/C23H24ClN3O2/c24-22-17-29-21-9-2-1-7-19(21)23(28)27(22)14-6-5-13-26-15-10-18(11-16-26)20-8-3-4-12-25-20/h1-4,7-10,12,17H,5-6,11,13-16H2Synonyms: Piclozotan | 3-CHLORO-4-(4-(1',2',3',6'-TETRAHYDRO-(2,4'-BIPYRIDIN)-1'-YL)BUTYL)-1,4-BENZOXAZEPIN-5(4H)-ONE | SUN-N40...
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LapaquistatCas Number: 189059-71-0 Compound CID: 9960389Formula: C31H39ClN2O8 Molecular Weight: 603.10IUPAC Name: 2-[1-[2-[(3R,5S)-7-chloro-5-(2,3-dimethoxyphenyl)-1-(3-hydroxy-2,2-dimethylpropyl)-2-oxo-5H-4,1-benzoxazepin-3-yl]acetyl]piperidin-4-yl]acetic acidSMILES: CC(C)(CN1C2=C(C=C(C=C2)Cl)C(OC(C1=O)CC(=O)N3CCC(CC3)CC(=O)O)C4=C(C(=CC=C4)OC)OC)COInChIKey: HDGUKVZPMPJBFK-LEAFIULHSA-NInChI: show more Synonyms: SCHEMBL227295 | 2-(1-(2-((3R,5S)-1-(3-hydroxy-2,2-dimethylpropyl)-7-chloro-5-(2,3- dimethoxyphenyl)-2-oxo-1,2,3,5-tet...
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PBOX 6Cas Number: 290814-68-5 Compound CID: 9865511Formula: C25H20N2O3 Molecular Weight: 396.44IUPAC Name: (6-naphthalen-1-ylpyrrolo[2,1-d][1,5]benzoxazepin-7-yl) N,N-dimethylcarbamateSMILES: CN(C)C(=O)OC1=C(OC2=CC=CC=C2N3C1=CC=C3)C4=CC=CC5=CC=CC=C54InChIKey: SOIZAFVNIXAZFQ-UHFFFAOYSA-NInChI: InChI=1S/C25H20N2O3/c1-26(2)25(28)30-24-21-14-8-16-27(21)20-13-5-6-15-22(20)29-23(24)19-12-7-10-17-9-3-4-11-18(17)19/h3-16H,1-2H3Synonyms: PBOX-6 | CS-0035400 | 7-[(N,N-dimethylcarbamoyl)oxy]-6-(naphth-1-yl)pyrrolo[2,1-d][1,5]benzoxazepine | MS-26682 | HY-...
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Eleclazine hydrochlorideCas Number: 1448754-43-5 Compound CID: 90479986Formula: C21H17ClF3N3O3 Molecular Weight: 451.8IUPAC Name: 4-(pyrimidin-2-ylmethyl)-7-[4-(trifluoromethoxy)phenyl]-2,3-dihydro-1,4-benzoxazepin-5-one;hydrochlorideSMILES: C1COC2=C(C=C(C=C2)C3=CC=C(C=C3)OC(F)(F)F)C(=O)N1CC4=NC=CC=N4.ClInChIKey: ZRYHNOXHGYUHFF-UHFFFAOYSA-NInChI: InChI=1S/C21H16F3N3O3.ClH/c22-21(23,24)30-16-5-2-14(3-6-16)15-4-7-18-17(12-15)20(28)27(10-11-29-18)13-19-25-8-1-9-26-19;/h1-9,12H,10-11,13H2;1HSynonyms: BS-15137 | 1622226-81-6 | 4-(pyrimidin-2-ylmethyl)-7-[4-(trifluoromethoxy)phenyl]-2,3-dihydro-1,4-benzoxazepin-5-one;...
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TPOP146Cas Number: 2018300-62-2 Compound CID: 122172830Formula: C27H35N3O5 Molecular Weight: 481.58IUPAC Name: 7-(3,5-dimethoxyphenyl)-N-[(3S)-1-methylpiperidin-3-yl]-4-propanoyl-3,5-dihydro-2H-1,4-benzoxazepine-9-carboxamideSMILES: CCC(=O)N1CCOC2=C(C1)C=C(C=C2C(=O)NC3CCCN(C3)C)C4=CC(=CC(=C4)OC)OCInChIKey: CUJLWYCUPPPASA-NRFANRHFSA-NInChI: show more
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tert-butyl 7-bromo-2,3,4,5-tetrahydro-1,4-benzoxazepine-4-carboxylateCas Number: 740842-73-3 Compound CID: 25220760Formula: C14H18BrNO3 Molecular Weight: 328.2IUPAC Name: tert-butyl 7-bromo-3,5-dihydro-2H-1,4-benzoxazepine-4-carboxylateSMILES: CC(C)(C)OC(=O)N1CCOC2=C(C1)C=C(C=C2)BrInChIKey: GOTCHZNAPXYRGA-UHFFFAOYSA-NInChI: InChI=1S/C14H18BrNO3/c1-14(2,3)19-13(17)16-6-7-18-12-5-4-11(15)8-10(12)9-16/h4-5,8H,6-7,9H2,1-3H3Synonyms: 1,1-Dimethylethyl 7-bromo-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxylate | tert-Butyl-7-bromo-2,3-dihydrobenzo[f][1,...
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8-bromo-3,4-dihydro-2H-1,4-benzoxazepin-5-oneFormula: C9H8NO2Br Molecular Weight: 242.07IUPAC Name: 8-bromo-3,4-dihydro-2H-1,4-benzoxazepin-5-oneSMILES: C1COC2=C(C=CC(=C2)Br)C(=O)N1InChIKey: OQXPXEVRPQEGOM-UHFFFAOYSA-NInChI: InChI=1S/C9H8BrNO2/c10-6-1-2-7-8(5-6)13-4-3-11-9(7)12/h1-2,5H,3-4H2,(H,11,12)Synonyms: AT16071 | AKOS023599023 | 1396777-41-5 | 8-bromo-2,3,4,5-tetrahydro-1,4-benzoxazepin-5-one | OQXPXEVRPQEGOM-UHFFFAOYS...
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methyl 2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxylateCas Number: 1206229-01-7 Compound CID: 59604947IUPAC Name: methyl 2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxylateSMILES: COC(=O)C1=CC2=C(C=C1)OCCNC2InChIKey: LQFQIFFNTMBWRJ-UHFFFAOYSA-NInChI: InChI=1S/C11H13NO3/c1-14-11(13)8-2-3-10-9(6-8)7-12-4-5-15-10/h2-3,6,12H,4-5,7H2,1H3Synonyms: methyl 2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxylate | DTXSID501196908 | AKOS026706487 | F1907-0691 | CS-0442035...
