[1-oxidanylidene-1-[(2-phenylphenyl)amino]propan-2-yl] 3-methyl-4-nitro-benzoate

Systemtic Name: [1-oxidanylidene-1-[(2-phenylphenyl)amino]propan-2-yl] 3-methyl-4-nitro-benzoate Openeye Name: [1-methyl-2-oxo-2-(2-phenylanilino)ethyl] 3-methyl-4-nitro-benzoate CAS Name: 3-methyl-4-nitrobenzoic acid [1-oxo-1-(2-phenylanilino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(2-phenylanilino)propan-2-yl] 3-methyl-4-nitrobenzoate Traditional Name: 3-methyl-4-nitro-benzoic acid [2-keto-1-methyl-2-(2-phenylanilino)ethyl] ester Formula: C23H20N2O5 MolecularWeight: 404.4153

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OC(C)C(=O)NC2=CC=CC=C2C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OC(C)C(=O)NC2=CC=CC=C2C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H20N2O5/c1-15-14-18(12-13-21(15)25(28)29)23(27)30-16(2)22(26)24-20-11-7-6-10-19(20)17-8-4-3-5-9-17/h3-14,16H,1-2H3,(H,24,26)