[2-methoxy-4-[(E)-C-methyl-N-[(4-pyrrol-1-ylphenyl)carbonylamino]carbonimidoyl]phenyl] 4-chloranylbenzoate

Systemtic Name: [2-methoxy-4-[(E)-C-methyl-N-[(4-pyrrol-1-ylphenyl)carbonylamino]carbonimidoyl]phenyl] 4-chloranylbenzoate Openeye Name: [2-methoxy-4-[(E)-C-methyl-N-[(4-pyrrol-1-ylbenzoyl)amino]carbonimidoyl]phenyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [2-methoxy-4-[(1E)-1-[[oxo-[4-(1-pyrrolyl)phenyl]methyl]hydrazinylidene]ethyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-C-methyl-N-[(4-pyrrol-1-ylbenzoyl)amino]carbonimidoyl]phenyl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [2-methoxy-4-[(E)-C-methyl-N-[(4-pyrrol-1-ylbenzoyl)amino]carbonimidoyl]phenyl] ester Formula: C27H22ClN3O4 MolecularWeight: 487.93428

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C/C(=N\NC(=O)C1=CC=C(C=C1)N2C=CC=C2)/C3=CC(=C(C=C3)OC(=O)C4=CC=C(C=C4)Cl)OC

InChI

InChI=1S/C27H22ClN3O4/c1-18(29-30-26(32)19-7-12-23(13-8-19)31-15-3-4-16-31)21-9-14-24(25(17-21)34-2)35-27(33)20-5-10-22(28)11-6-20/h3-17H,1-2H3,(H,30,32)/b29-18+