[2-oxidanylidene-2-[[2-(phenylcarbonyl)phenyl]amino]ethyl] 4-methyl-3-nitro-benzoate

Systemtic Name: [2-oxidanylidene-2-[[2-(phenylcarbonyl)phenyl]amino]ethyl] 4-methyl-3-nitro-benzoate Openeye Name: [2-(2-benzoylanilino)-2-oxo-ethyl] 4-methyl-3-nitro-benzoate CAS Name: 4-methyl-3-nitrobenzoic acid [2-(2-benzoylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-benzoylanilino)-2-oxoethyl] 4-methyl-3-nitrobenzoate Traditional Name: 4-methyl-3-nitro-benzoic acid [2-(2-benzoylanilino)-2-keto-ethyl] ester Formula: C23H18N2O6 MolecularWeight: 418.39882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC(=O)NC2=CC=CC=C2C(=O)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC(=O)NC2=CC=CC=C2C(=O)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H18N2O6/c1-15-11-12-17(13-20(15)25(29)30)23(28)31-14-21(26)24-19-10-6-5-9-18(19)22(27)16-7-3-2-4-8-16/h2-13H,14H2,1H3,(H,24,26)