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

Systemtic Name: [1-[(2,4-dimethoxyphenyl)amino]-1-oxidanylidene-butan-2-yl] 4-(4-chlorophenyl)-2-methyl-1-oxidanylidene-isoquinoline-3-carboxylate Openeye Name: 1-[(2,4-dimethoxyphenyl)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-(2,4-dimethoxyanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(2,4-dimethoxyanilino)-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-[(2,4-dimethoxyphenyl)carbamoyl]propyl ester Formula: C29H27ClN2O6 MolecularWeight: 534.98748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(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

CCC(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/C29H27ClN2O6/c1-5-23(27(33)31-22-15-14-19(36-3)16-24(22)37-4)38-29(35)26-25(17-10-12-18(30)13-11-17)20-8-6-7-9-21(20)28(34)32(26)2/h6-16,23H,5H2,1-4H3,(H,31,33)