[(2S)-1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl] 2-[(4-nitrophenyl)carbonylamino]benzoate

Systemtic Name: [(2S)-1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl] 2-[(4-nitrophenyl)carbonylamino]benzoate Openeye Name: [(1S)-1-methyl-2-oxo-2-(p-tolyl)ethyl] 2-[(4-nitrobenzoyl)amino]benzoate CAS Name: 2-[[(4-nitrophenyl)-oxomethyl]amino]benzoic acid [(2S)-1-(4-methylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(4-methylphenyl)-1-oxopropan-2-yl] 2-[(4-nitrobenzoyl)amino]benzoate Traditional Name: 2-[(4-nitrobenzoyl)amino]benzoic acid [(1S)-2-keto-1-methyl-2-(p-tolyl)ethyl] ester Formula: C24H20N2O6 MolecularWeight: 432.4254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(C)OC(=O)C2=CC=CC=C2NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)[C@H](C)OC(=O)C2=CC=CC=C2NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H20N2O6/c1-15-7-9-17(10-8-15)22(27)16(2)32-24(29)20-5-3-4-6-21(20)25-23(28)18-11-13-19(14-12-18)26(30)31/h3-14,16H,1-2H3,(H,25,28)/t16-/m0/s1