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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H15NO5/c19-16(11-8-13-4-2-1-3-5-13)17(20)23-12-14-6-9-15(10-7-14)18(21)22/h1-7,9-10H,8,11-12H2