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

Systemtic Name: [1-[(2-methylquinolin-4-yl)amino]-1-oxidanylidene-propan-2-yl] 4-(4-chlorophenyl)-2-methyl-1-oxidanylidene-isoquinoline-3-carboxylate Openeye Name: [1-methyl-2-[(2-methyl-4-quinolyl)amino]-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-methyl-4-quinolinyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(2-methylquinolin-4-yl)amino]-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-keto-1-methyl-2-[(2-methyl-4-quinolyl)amino]ethyl] ester Formula: C30H24ClN3O4 MolecularWeight: 525.98226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)NC(=O)C(C)OC(=O)C3=C(C4=CC=CC=C4C(=O)N3C)C5=CC=C(C=C5)Cl

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)NC(=O)C(C)OC(=O)C3=C(C4=CC=CC=C4C(=O)N3C)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C30H24ClN3O4/c1-17-16-25(23-10-6-7-11-24(23)32-17)33-28(35)18(2)38-30(37)27-26(19-12-14-20(31)15-13-19)21-8-4-5-9-22(21)29(36)34(27)3/h4-16,18H,1-3H3,(H,32,33,35)