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

Systemtic Name: [2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] 3-[(2,4-dinitrophenyl)carbonylamino]benzoate Openeye Name: [2-(4-methoxyphenyl)-2-oxo-ethyl] 3-[(2,4-dinitrobenzoyl)amino]benzoate CAS Name: 3-[[(2,4-dinitrophenyl)-oxomethyl]amino]benzoic acid [2-(4-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methoxyphenyl)-2-oxoethyl] 3-[(2,4-dinitrobenzoyl)amino]benzoate Traditional Name: 3-[(2,4-dinitrobenzoyl)amino]benzoic acid [2-keto-2-(4-methoxyphenyl)ethyl] ester Formula: C23H17N3O9 MolecularWeight: 479.39578

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=CC=C2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=CC=C2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C23H17N3O9/c1-34-18-8-5-14(6-9-18)21(27)13-35-23(29)15-3-2-4-16(11-15)24-22(28)19-10-7-17(25(30)31)12-20(19)26(32)33/h2-12H,13H2,1H3,(H,24,28)