(phenylmethyl) N-[(2S)-1-cyano-3-methyl-1-oxidanyl-butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-cyano-3-methyl-1-oxidanyl-butan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-[cyano(hydroxy)methyl]-2-methyl-propyl]carbamate CAS Name: N-[(2S)-1-cyano-1-hydroxy-3-methylbutan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-cyano-1-hydroxy-3-methylbutan-2-yl]carbamate Traditional Name: N-[(1S)-1-[cyano(hydroxy)methyl]-2-methyl-propyl]carbamic acid benzyl ester Formula: C14H18N2O3 MolecularWeight: 262.30432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C#N)O)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)[C@@H](C(C#N)O)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C14H18N2O3/c1-10(2)13(12(17)8-15)16-14(18)19-9-11-6-4-3-5-7-11/h3-7,10,12-13,17H,9H2,1-2H3,(H,16,18)/t12?,13-/m0/s1