[3-[(E)-2-cyano-3-[(4-methoxy-2-nitro-phenyl)amino]-3-oxidanylidene-prop-1-enyl]phenyl] 4-chloranylbenzoate

Systemtic Name: [3-[(E)-2-cyano-3-[(4-methoxy-2-nitro-phenyl)amino]-3-oxidanylidene-prop-1-enyl]phenyl] 4-chloranylbenzoate Openeye Name: [3-[(E)-2-cyano-3-(4-methoxy-2-nitro-anilino)-3-oxo-prop-1-enyl]phenyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [3-[(E)-2-cyano-3-(4-methoxy-2-nitroanilino)-3-oxoprop-1-enyl]phenyl] ester IUPAC Name: [3-[(E)-2-cyano-3-(4-methoxy-2-nitroanilino)-3-oxoprop-1-enyl]phenyl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [3-[(E)-2-cyano-3-keto-3-(4-methoxy-2-nitro-anilino)prop-1-enyl]phenyl] ester Formula: C24H16ClN3O6 MolecularWeight: 477.85334

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)C(=CC2=CC(=CC=C2)OC(=O)C3=CC=C(C=C3)Cl)C#N)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)/C(=C/C2=CC(=CC=C2)OC(=O)C3=CC=C(C=C3)Cl)/C#N)[N+](=O)[O-]

InChI

InChI=1S/C24H16ClN3O6/c1-33-19-9-10-21(22(13-19)28(31)32)27-23(29)17(14-26)11-15-3-2-4-20(12-15)34-24(30)16-5-7-18(25)8-6-16/h2-13H,1H3,(H,27,29)/b17-11+