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

Systemtic Name: [2-(4-chlorophenyl)-2-oxidanylidene-1-phenyl-ethyl] 2-nitrobenzoate Openeye Name: [2-(4-chlorophenyl)-2-oxo-1-phenyl-ethyl] 2-nitrobenzoate CAS Name: 2-nitrobenzoic acid [2-(4-chlorophenyl)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(4-chlorophenyl)-2-oxo-1-phenylethyl] 2-nitrobenzoate Traditional Name: 2-nitrobenzoic acid [2-(4-chlorophenyl)-2-keto-1-phenyl-ethyl] ester Formula: C21H14ClNO5 MolecularWeight: 395.79256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H14ClNO5/c22-16-12-10-14(11-13-16)19(24)20(15-6-2-1-3-7-15)28-21(25)17-8-4-5-9-18(17)23(26)27/h1-13,20H