[2-[(E)-C-methyl-N-[(2-pyrrol-1-ylphenyl)carbonylamino]carbonimidoyl]phenyl] 3-chloranylbenzoate

Systemtic Name: [2-[(E)-C-methyl-N-[(2-pyrrol-1-ylphenyl)carbonylamino]carbonimidoyl]phenyl] 3-chloranylbenzoate Openeye Name: [2-[(E)-C-methyl-N-[(2-pyrrol-1-ylbenzoyl)amino]carbonimidoyl]phenyl] 3-chlorobenzoate CAS Name: 3-chlorobenzoic acid [2-[(1E)-1-[[oxo-[2-(1-pyrrolyl)phenyl]methyl]hydrazinylidene]ethyl]phenyl] ester IUPAC Name: [2-[(E)-C-methyl-N-[(2-pyrrol-1-ylbenzoyl)amino]carbonimidoyl]phenyl] 3-chlorobenzoate Traditional Name: 3-chlorobenzoic acid [2-[(E)-C-methyl-N-[(2-pyrrol-1-ylbenzoyl)amino]carbonimidoyl]phenyl] ester Formula: C26H20ClN3O3 MolecularWeight: 457.9083

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC=CC=C1N2C=CC=C2)C3=CC=CC=C3OC(=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

C/C(=N\NC(=O)C1=CC=CC=C1N2C=CC=C2)/C3=CC=CC=C3OC(=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C26H20ClN3O3/c1-18(28-29-25(31)22-12-2-4-13-23(22)30-15-6-7-16-30)21-11-3-5-14-24(21)33-26(32)19-9-8-10-20(27)17-19/h2-17H,1H3,(H,29,31)/b28-18+