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

Systemtic Name: (4-nitrophenyl)methyl 4-oxidanylidene-2-phenyl-butanoate Openeye Name: (4-nitrophenyl)methyl 4-oxo-2-phenyl-butanoate CAS Name: 4-oxo-2-phenylbutanoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 4-oxo-2-phenylbutanoate Traditional Name: 4-keto-2-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)C(CC=O)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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