[(Z)-3-acetamido-3-cyano-1-phenyl-prop-1-enyl]phosphonic acid

Systemtic Name: [(Z)-3-acetamido-3-cyano-1-phenyl-prop-1-enyl]phosphonic acid Openeye Name: [(Z)-3-acetamido-3-cyano-1-phenyl-prop-1-enyl]phosphonic acid CAS Name: [(Z)-3-acetamido-3-cyano-1-phenylprop-1-enyl]phosphonic acid IUPAC Name: [(Z)-3-acetamido-3-cyano-1-phenylprop-1-enyl]phosphonic acid Traditional Name: [(Z)-3-acetamido-3-cyano-1-phenyl-prop-1-enyl]phosphonic acid Formula: C12H13N2O4P MolecularWeight: 280.216381

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C=C(C1=CC=CC=C1)P(=O)(O)O)C#N

Isomeric SMILES

CC(=O)NC(/C=C(/C1=CC=CC=C1)\P(=O)(O)O)C#N

InChI

InChI=1S/C12H13N2O4P/c1-9(15)14-11(8-13)7-12(19(16,17)18)10-5-3-2-4-6-10/h2-7,11H,1H3,(H,14,15)(H2,16,17,18)/b12-7-