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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H9NO5/c12-9(4-5-10(13)14)7-2-1-3-8(6-7)11(15)16/h1-3,6H,4-5H2,(H,13,14)/p-1