[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 4-(methylamino)-3-nitro-benzoate

Systemtic Name: [2-[(4-methoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 4-(methylamino)-3-nitro-benzoate Openeye Name: [2-(4-methoxyanilino)-2-oxo-1-phenyl-ethyl] 4-(methylamino)-3-nitro-benzoate CAS Name: 4-(methylamino)-3-nitrobenzoic acid [2-(4-methoxyanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(4-methoxyanilino)-2-oxo-1-phenylethyl] 4-(methylamino)-3-nitrobenzoate Traditional Name: 4-(methylamino)-3-nitro-benzoic acid [2-keto-2-(p-anisidino)-1-phenyl-ethyl] ester Formula: C23H21N3O6 MolecularWeight: 435.42934

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)OC(C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)OC(C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C23H21N3O6/c1-24-19-13-8-16(14-20(19)26(29)30)23(28)32-21(15-6-4-3-5-7-15)22(27)25-17-9-11-18(31-2)12-10-17/h3-14,21,24H,1-2H3,(H,25,27)