[2-(3-nitrophenyl)-2-oxidanylidene-ethyl] 4-[(4-nitrophenyl)carbonylamino]benzoate

Systemtic Name: [2-(3-nitrophenyl)-2-oxidanylidene-ethyl] 4-[(4-nitrophenyl)carbonylamino]benzoate Openeye Name: [2-(3-nitrophenyl)-2-oxo-ethyl] 4-[(4-nitrobenzoyl)amino]benzoate CAS Name: 4-[[(4-nitrophenyl)-oxomethyl]amino]benzoic acid [2-(3-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-nitrophenyl)-2-oxoethyl] 4-[(4-nitrobenzoyl)amino]benzoate Traditional Name: 4-[(4-nitrobenzoyl)amino]benzoic acid [2-keto-2-(3-nitrophenyl)ethyl] ester Formula: C22H15N3O8 MolecularWeight: 449.3698

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)COC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)COC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H15N3O8/c26-20(16-2-1-3-19(12-16)25(31)32)13-33-22(28)15-4-8-17(9-5-15)23-21(27)14-6-10-18(11-7-14)24(29)30/h1-12H,13H2,(H,23,27)