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Phenylketones
Description:
Aromatic compounds containing a ketone substituted by one aryl group.
Ancestors:
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tert-Butyl 4-(4-acetylphenyl)-piperazine-1-carboxylateCas Number: 189763-86-8 Compound CID: 21136190IUPAC Name: tert-butyl 4-(4-acetylphenyl)piperazine-1-carboxylateSMILES: CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)OC(C)(C)CInChIKey: RNENNIIGKWIJDK-UHFFFAOYSA-NInChI: InChI=1S/C17H24N2O3/c1-13(20)14-5-7-15(8-6-14)18-9-11-19(12-10-18)16(21)22-17(2,3)4/h5-8H,9-12H2,1-4H3 -
Tienilic AcidFormula: C13H8Cl2O4S Molecular Weight: 331.17IUPAC Name: 2-[2,3-dichloro-4-(thiophene-2-carbonyl)phenoxy]acetic acidSMILES: C1=CSC(=C1)C(=O)C2=C(C(=C(C=C2)OCC(=O)O)Cl)ClInChIKey: AGHANLSBXUWXTB-UHFFFAOYSA-NInChI: InChI=1S/C13H8Cl2O4S/c14-11-7(13(18)9-2-1-5-20-9)3-4-8(12(11)15)19-6-10(16)17/h1-5H,6H2,(H,16,17)Synonyms: [2,3-Dichloro-4-(2-thienylcarbonyl)phenoxy]-acetic acid | Tienylic acid | Ticrynafen
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[2-(2-fluorophenyl)-2-oxoethyl]propanedinitrileIUPAC Name: 2-[2-(2-fluorophenyl)-2-oxoethyl]propanedinitrileSMILES: C1=CC=C(C(=C1)C(=O)CC(C#N)C#N)FInChIKey: NOUFLZSMHQHSHA-UHFFFAOYSA-NInChI: InChI=1S/C11H7FN2O/c12-10-4-2-1-3-9(10)11(15)5-8(6-13)7-14/h1-4,8H,5H2
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Zomepirac sodium saltCas Number: 64092-48-4 Compound CID: 16220118Formula: C15H13ClNO3Na Molecular Weight: 313.71IUPAC Name: sodium;2-[5-(4-chlorobenzoyl)-1,4-dimethylpyrrol-2-yl]acetateSMILES: CC1=C(N(C(=C1)CC(=O)[O-])C)C(=O)C2=CC=C(C=C2)Cl.[Na+]InChIKey: SEEXPXUCHVGZGU-UHFFFAOYSA-MInChI: InChI=1S/C15H14ClNO3.Na/c1-9-7-12(8-13(18)19)17(2)14(9)15(20)10-3-5-11(16)6-4-10;/h3-7H,8H2,1-2H3,(H,18,19);/q;+1/p-1
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Methyl 4-acetyl-3-nitrobenzoateCas Number: 51885-81-5 Compound CID: 19047729Formula: C10H9NO5 Molecular Weight: 223.18IUPAC Name: methyl 4-acetyl-3-nitrobenzoateSMILES: CC(=O)C1=C(C=C(C=C1)C(=O)OC)[N+](=O)[O-]InChIKey: RWLGQQWVBIMMEG-UHFFFAOYSA-NInChI: InChI=1S/C10H9NO5/c1-6(12)8-4-3-7(10(13)16-2)5-9(8)11(14)15/h3-5H,1-2H3
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Methyl 2-Acetoxy-5-AcetylbenzoateCas Number: 61414-18-4 Compound CID: 11139098IUPAC Name: methyl 5-acetyl-2-acetyloxybenzoateSMILES: CC(=O)C1=CC(=C(C=C1)OC(=O)C)C(=O)OCInChIKey: CYYCWWDFSBYNQW-UHFFFAOYSA-NInChI: InChI=1S/C12H12O5/c1-7(13)9-4-5-11(17-8(2)14)10(6-9)12(15)16-3/h4-6H,1-3H3
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Ethyl2-benzoylbutanoateIUPAC Name: ethyl 2-benzoylbutanoateSMILES: CCC(C(=O)C1=CC=CC=C1)C(=O)OCCInChIKey: NZRZNJONGRRTNF-UHFFFAOYSA-NInChI: InChI=1S/C13H16O3/c1-3-11(13(15)16-4-2)12(14)10-8-6-5-7-9-10/h5-9,11H,3-4H2,1-2H3
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Cyclopentyl(3，4-dichlorophenyl)methanoneCas Number: 898791-87-2 Compound CID: 24261642Formula: C12H12Cl2O Molecular Weight: 243.13IUPAC Name: cyclopentyl-(3,4-dichlorophenyl)methanoneSMILES: C1CCC(C1)C(=O)C2=CC(=C(C=C2)Cl)ClInChIKey: MUEMEOICNHKBDH-UHFFFAOYSA-NInChI: InChI=1S/C12H12Cl2O/c13-10-6-5-9(7-11(10)14)12(15)8-3-1-2-4-8/h5-8H,1-4H2
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5-(3-FLUOROPHENYL)-5-OXOVALERIC ACIDCas Number: 845790-38-7 Compound CID: 2759127Formula: C11H11FO3 Molecular Weight: 210.21IUPAC Name: 5-(3-fluorophenyl)-5-oxopentanoic acidSMILES: C1=CC(=CC(=C1)F)C(=O)CCCC(=O)OInChIKey: VMDBDUOSNLRJAG-UHFFFAOYSA-NInChI: InChI=1S/C11H11FO3/c12-9-4-1-3-8(7-9)10(13)5-2-6-11(14)15/h1,3-4,7H,2,5-6H2,(H,14,15)
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4'-Ethoxy-2-methylpropiophenoneCas Number: 72846-63-0Formula: C12H16O2 Molecular Weight: 192.2542SMILES: CCOC1=CC=C(C=C1)C(=O)C(C)CInChIKey: POGPSKUWSGOZRN-UHFFFAOYSA-NInChI: InChI=1S/C12H16O2/c1-4-14-11-7-5-10(6-8-11)12(13)9(2)3/h5-9H,4H2,1-3H3
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4-(3-tosyl-2-(tosylmethyl)propanoyl)benzoic acidCas Number: 124243-00-1 Compound CID: 6420086Formula: C25H24O7S2 Molecular Weight: 500.6IUPAC Name: 4-[3-(4-methylphenyl)sulfonyl-2-[(4-methylphenyl)sulfonylmethyl]propanoyl]benzoic acidSMILES: CC1=CC=C(C=C1)S(=O)(=O)CC(CS(=O)(=O)C2=CC=C(C=C2)C)C(=O)C3=CC=C(C=C3)C(=O)OInChIKey: HGOBHXGITKMPPL-UHFFFAOYSA-NInChI: show more
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3'-Methoxy-4'-methylacetophenoneCas Number: 3556-81-8 Compound CID: 10130124Formula: C10H12O2 Molecular Weight: 164.2IUPAC Name: 1-(3-methoxy-4-methylphenyl)ethanoneSMILES: CC1=C(C=C(C=C1)C(=O)C)OCInChIKey: SZYKDYIBUSNYRS-UHFFFAOYSA-NInChI: InChI=1S/C10H12O2/c1-7-4-5-9(8(2)11)6-10(7)12-3/h4-6H,1-3H3
