methyl 2-(4-nitrophenyl)-4-oxidanylidene-4-phenyl-butanoate

Systemtic Name: methyl 2-(4-nitrophenyl)-4-oxidanylidene-4-phenyl-butanoate Openeye Name: methyl 2-(4-nitrophenyl)-4-oxo-4-phenyl-butanoate CAS Name: 2-(4-nitrophenyl)-4-oxo-4-phenylbutanoic acid methyl ester IUPAC Name: methyl 2-(4-nitrophenyl)-4-oxo-4-phenylbutanoate Traditional Name: 4-keto-2-(4-nitrophenyl)-4-phenyl-butyric acid methyl ester Formula: C17H15NO5 MolecularWeight: 313.3047

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC(=O)C1=CC=CC=C1)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C(CC(=O)C1=CC=CC=C1)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H15NO5/c1-23-17(20)15(11-16(19)13-5-3-2-4-6-13)12-7-9-14(10-8-12)18(21)22/h2-10,15H,11H2,1H3