[2-(4-methylphenyl)-2-oxidanylidene-1-phenyl-ethyl] 4-nitrobenzoate

Systemtic Name: [2-(4-methylphenyl)-2-oxidanylidene-1-phenyl-ethyl] 4-nitrobenzoate Openeye Name: [2-oxo-1-phenyl-2-(p-tolyl)ethyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [2-(4-methylphenyl)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(4-methylphenyl)-2-oxo-1-phenylethyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [2-keto-1-phenyl-2-(p-tolyl)ethyl] ester Formula: C22H17NO5 MolecularWeight: 375.37408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H17NO5/c1-15-7-9-16(10-8-15)20(24)21(17-5-3-2-4-6-17)28-22(25)18-11-13-19(14-12-18)23(26)27/h2-14,21H,1H3