[(E)-1-(3-nitrophenyl)-3-oxidanylidene-but-1-en-2-yl]phosphonic acid

Systemtic Name: [(E)-1-(3-nitrophenyl)-3-oxidanylidene-but-1-en-2-yl]phosphonic acid Openeye Name: [(1E)-1-[(3-nitrophenyl)methylene]-2-oxo-propyl]phosphonic acid CAS Name: [(E)-1-(3-nitrophenyl)-3-oxobut-1-en-2-yl]phosphonic acid IUPAC Name: [(E)-1-(3-nitrophenyl)-3-oxobut-1-en-2-yl]phosphonic acid Traditional Name: [(E)-1-acetyl-2-(3-nitrophenyl)vinyl]phosphonic acid Formula: C10H10NO6P MolecularWeight: 271.163261

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CC(=CC=C1)[N+](=O)[O-])P(=O)(O)O

Isomeric SMILES

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

InChI

InChI=1S/C10H10NO6P/c1-7(12)10(18(15,16)17)6-8-3-2-4-9(5-8)11(13)14/h2-6H,1H3,(H2,15,16,17)/b10-6+