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

Systemtic Name: [2-(3-nitrophenyl)-2-oxidanylidene-ethyl] 2-[(2,4-dinitrophenyl)carbonylamino]benzoate Openeye Name: [2-(3-nitrophenyl)-2-oxo-ethyl] 2-[(2,4-dinitrobenzoyl)amino]benzoate CAS Name: 2-[[(2,4-dinitrophenyl)-oxomethyl]amino]benzoic acid [2-(3-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-nitrophenyl)-2-oxoethyl] 2-[(2,4-dinitrobenzoyl)amino]benzoate Traditional Name: 2-[(2,4-dinitrobenzoyl)amino]benzoic acid [2-keto-2-(3-nitrophenyl)ethyl] ester Formula: C22H14N4O10 MolecularWeight: 494.36736

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H14N4O10/c27-20(13-4-3-5-14(10-13)24(30)31)12-36-22(29)16-6-1-2-7-18(16)23-21(28)17-9-8-15(25(32)33)11-19(17)26(34)35/h1-11H,12H2,(H,23,28)