(phenylmethyl) 2-cyano-2-dimethoxyphosphoryloxy-2-phenyl-ethanoate

Systemtic Name: (phenylmethyl) 2-cyano-2-dimethoxyphosphoryloxy-2-phenyl-ethanoate Openeye Name: benzyl 2-cyano-2-dimethoxyphosphoryloxy-2-phenyl-acetate CAS Name: 2-cyano-2-dimethoxyphosphoryloxy-2-phenylacetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-cyano-2-dimethoxyphosphoryloxy-2-phenylacetate Traditional Name: 2-cyano-2-dimethoxyphosphoryloxy-2-phenyl-acetic acid benzyl ester Formula: C18H18NO6P MolecularWeight: 375.312381

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Descriptors Computed from Structure

Canonical SMILES:

COP(=O)(OC)OC(C#N)(C1=CC=CC=C1)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

COP(=O)(OC)OC(C#N)(C1=CC=CC=C1)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H18NO6P/c1-22-26(21,23-2)25-18(14-19,16-11-7-4-8-12-16)17(20)24-13-15-9-5-3-6-10-15/h3-12H,13H2,1-2H3