(3S)-3-(4-nitrophenyl)-2-oxidanylidene-butanoate

Systemtic Name: (3S)-3-(4-nitrophenyl)-2-oxidanylidene-butanoate Openeye Name: (3S)-3-(4-nitrophenyl)-2-oxo-butanoate CAS Name: (3S)-3-(4-nitrophenyl)-2-oxobutanoate IUPAC Name: (3S)-3-(4-nitrophenyl)-2-oxobutanoate Traditional Name: (3S)-2-keto-3-(4-nitrophenyl)butyrate Formula: C10H8NO5- MolecularWeight: 222.17422

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)[N+](=O)[O-])C(=O)C(=O)[O-]

InChI

InChI=1S/C10H9NO5/c1-6(9(12)10(13)14)7-2-4-8(5-3-7)11(15)16/h2-6H,1H3,(H,13,14)/p-1/t6-/m0/s1