[1-[(2-methoxycarbonylphenyl)amino]-1-oxidanylidene-butan-2-yl] 4-(4-chlorophenyl)-2-methyl-1-oxidanylidene-isoquinoline-3-carboxylate

Systemtic Name: [1-[(2-methoxycarbonylphenyl)amino]-1-oxidanylidene-butan-2-yl] 4-(4-chlorophenyl)-2-methyl-1-oxidanylidene-isoquinoline-3-carboxylate Openeye Name: 1-[(2-methoxycarbonylphenyl)carbamoyl]propyl 4-(4-chlorophenyl)-2-methyl-1-oxo-isoquinoline-3-carboxylate CAS Name: 4-(4-chlorophenyl)-2-methyl-1-oxo-3-isoquinolinecarboxylic acid [1-(2-methoxycarbonylanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(2-methoxycarbonylanilino)-1-oxobutan-2-yl] 4-(4-chlorophenyl)-2-methyl-1-oxoisoquinoline-3-carboxylate Traditional Name: 4-(4-chlorophenyl)-1-keto-2-methyl-isoquinoline-3-carboxylic acid 1-[(2-carbomethoxyphenyl)carbamoyl]propyl ester Formula: C29H25ClN2O6 MolecularWeight: 532.9716

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1C(=O)OC)OC(=O)C2=C(C3=CC=CC=C3C(=O)N2C)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1C(=O)OC)OC(=O)C2=C(C3=CC=CC=C3C(=O)N2C)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C29H25ClN2O6/c1-4-23(26(33)31-22-12-8-7-11-21(22)28(35)37-3)38-29(36)25-24(17-13-15-18(30)16-14-17)19-9-5-6-10-20(19)27(34)32(25)2/h5-16,23H,4H2,1-3H3,(H,31,33)