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

Systemtic Name: [2-(3-nitrophenyl)-2-oxidanylidene-ethyl] 4-[(3-nitrophenyl)carbonylamino]benzoate Openeye Name: [2-(3-nitrophenyl)-2-oxo-ethyl] 4-[(3-nitrobenzoyl)amino]benzoate CAS Name: 4-[[(3-nitrophenyl)-oxomethyl]amino]benzoic acid [2-(3-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-nitrophenyl)-2-oxoethyl] 4-[(3-nitrobenzoyl)amino]benzoate Traditional Name: 4-[(3-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(=CC=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(=CC=C3)[N+](=O)[O-]

InChI

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