[2-[4-(4-nitrophenoxy)phenyl]-2-oxidanylidene-ethyl] 3-[(4-methylphenyl)carbonylamino]benzoate

Systemtic Name: [2-[4-(4-nitrophenoxy)phenyl]-2-oxidanylidene-ethyl] 3-[(4-methylphenyl)carbonylamino]benzoate Openeye Name: [2-[4-(4-nitrophenoxy)phenyl]-2-oxo-ethyl] 3-[(4-methylbenzoyl)amino]benzoate CAS Name: 3-[[(4-methylphenyl)-oxomethyl]amino]benzoic acid [2-[4-(4-nitrophenoxy)phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(4-nitrophenoxy)phenyl]-2-oxoethyl] 3-[(4-methylbenzoyl)amino]benzoate Traditional Name: 3-(p-toluoylamino)benzoic acid [2-keto-2-[4-(4-nitrophenoxy)phenyl]ethyl] ester Formula: C29H22N2O7 MolecularWeight: 510.49418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C(=O)OCC(=O)C3=CC=C(C=C3)OC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C(=O)OCC(=O)C3=CC=C(C=C3)OC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C29H22N2O7/c1-19-5-7-21(8-6-19)28(33)30-23-4-2-3-22(17-23)29(34)37-18-27(32)20-9-13-25(14-10-20)38-26-15-11-24(12-16-26)31(35)36/h2-17H,18H2,1H3,(H,30,33)