(phenylmethyl) (2S)-2-[cyano(diethoxyphosphoryloxy)methyl]pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2S)-2-[cyano(diethoxyphosphoryloxy)methyl]pyrrolidine-1-carboxylate Openeye Name: benzyl (2S)-2-[cyano(diethoxyphosphoryloxy)methyl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-[cyano(diethoxyphosphoryloxy)methyl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-[cyano(diethoxyphosphoryloxy)methyl]pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[cyano(diethoxyphosphoryloxy)methyl]pyrrolidine-1-carboxylic acid benzyl ester Formula: C18H25N2O6P MolecularWeight: 396.374661

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(OCC)OC(C#N)C1CCCN1C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCOP(=O)(OCC)OC(C#N)[C@@H]1CCCN1C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H25N2O6P/c1-3-24-27(22,25-4-2)26-17(13-19)16-11-8-12-20(16)18(21)23-14-15-9-6-5-7-10-15/h5-7,9-10,16-17H,3-4,8,11-12,14H2,1-2H3/t16-,17?/m0/s1