[1-[(2,4-dimethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 4-(4-chlorophenyl)-2-methyl-1-oxidanylidene-isoquinoline-3-carboxylate

Systemtic Name: [1-[(2,4-dimethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 4-(4-chlorophenyl)-2-methyl-1-oxidanylidene-isoquinoline-3-carboxylate Openeye Name: [2-(2,4-dimethoxyanilino)-1-methyl-2-oxo-ethyl] 4-(4-chlorophenyl)-2-methyl-1-oxo-isoquinoline-3-carboxylate CAS Name: 4-(4-chlorophenyl)-2-methyl-1-oxo-3-isoquinolinecarboxylic acid [1-(2,4-dimethoxyanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2,4-dimethoxyanilino)-1-oxopropan-2-yl] 4-(4-chlorophenyl)-2-methyl-1-oxoisoquinoline-3-carboxylate Traditional Name: 4-(4-chlorophenyl)-1-keto-2-methyl-isoquinoline-3-carboxylic acid [2-(2,4-dimethoxyanilino)-2-keto-1-methyl-ethyl] ester Formula: C28H25ClN2O6 MolecularWeight: 520.9609

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)OC)OC)OC(=O)C2=C(C3=CC=CC=C3C(=O)N2C)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1)OC)OC)OC(=O)C2=C(C3=CC=CC=C3C(=O)N2C)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C28H25ClN2O6/c1-16(26(32)30-22-14-13-19(35-3)15-23(22)36-4)37-28(34)25-24(17-9-11-18(29)12-10-17)20-7-5-6-8-21(20)27(33)31(25)2/h5-16H,1-4H3,(H,30,32)