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

Systemtic Name: [2-methoxy-4-[(E)-C-methyl-N-[(2-pyrrol-1-ylphenyl)carbonylamino]carbonimidoyl]phenyl] 2-nitrobenzoate Openeye Name: [2-methoxy-4-[(E)-C-methyl-N-[(2-pyrrol-1-ylbenzoyl)amino]carbonimidoyl]phenyl] 2-nitrobenzoate CAS Name: 2-nitrobenzoic acid [2-methoxy-4-[(1E)-1-[[oxo-[2-(1-pyrrolyl)phenyl]methyl]hydrazinylidene]ethyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-C-methyl-N-[(2-pyrrol-1-ylbenzoyl)amino]carbonimidoyl]phenyl] 2-nitrobenzoate Traditional Name: 2-nitrobenzoic acid [2-methoxy-4-[(E)-C-methyl-N-[(2-pyrrol-1-ylbenzoyl)amino]carbonimidoyl]phenyl] ester Formula: C27H22N4O6 MolecularWeight: 498.48678

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC=CC=C1N2C=CC=C2)C3=CC(=C(C=C3)OC(=O)C4=CC=CC=C4[N+](=O)[O-])OC

Isomeric SMILES

C/C(=N\NC(=O)C1=CC=CC=C1N2C=CC=C2)/C3=CC(=C(C=C3)OC(=O)C4=CC=CC=C4[N+](=O)[O-])OC

InChI

InChI=1S/C27H22N4O6/c1-18(28-29-26(32)20-9-3-5-11-22(20)30-15-7-8-16-30)19-13-14-24(25(17-19)36-2)37-27(33)21-10-4-6-12-23(21)31(34)35/h3-17H,1-2H3,(H,29,32)/b28-18+