[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-[(2-methyl-4-nitro-phenyl)carbamoyl]-3-nitro-benzoate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-[(2-methyl-4-nitro-phenyl)carbamoyl]-3-nitro-benzoate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 2-[(2-methyl-4-nitro-phenyl)carbamoyl]-3-nitro-benzoate CAS Name: 2-[(2-methyl-4-nitroanilino)-oxomethyl]-3-nitrobenzoic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 2-[(2-methyl-4-nitrophenyl)carbamoyl]-3-nitrobenzoate Traditional Name: 2-[(2-methyl-4-nitro-phenyl)carbamoyl]-3-nitro-benzoic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C23H16BrN3O8 MolecularWeight: 542.29244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C2=C(C=CC=C2[N+](=O)[O-])C(=O)OCC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C2=C(C=CC=C2[N+](=O)[O-])C(=O)OCC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C23H16BrN3O8/c1-13-11-16(26(31)32)9-10-18(13)25-22(29)21-17(3-2-4-19(21)27(33)34)23(30)35-12-20(28)14-5-7-15(24)8-6-14/h2-11H,12H2,1H3,(H,25,29)