2-diethoxyphosphoryl-2-phenyl-ethanenitrile

Systemtic Name: 2-diethoxyphosphoryl-2-phenyl-ethanenitrile Openeye Name: 2-diethoxyphosphoryl-2-phenyl-acetonitrile CAS Name: 2-diethoxyphosphoryl-2-phenylacetonitrile IUPAC Name: 2-diethoxyphosphoryl-2-phenylacetonitrile Traditional Name: 2-diethoxyphosphoryl-2-phenyl-acetonitrile Formula: C12H16NO3P MolecularWeight: 253.234101

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(C#N)C1=CC=CC=C1)OCC

Isomeric SMILES

CCOP(=O)(C(C#N)C1=CC=CC=C1)OCC

InChI

InChI=1S/C12H16NO3P/c1-3-15-17(14,16-4-2)12(10-13)11-8-6-5-7-9-11/h5-9,12H,3-4H2,1-2H3