(phenylmethyl) N-[(1S,2R)-1-cyano-4-methyl-1-phenyl-pentan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(1S,2R)-1-cyano-4-methyl-1-phenyl-pentan-2-yl]carbamate Openeye Name: benzyl N-[(1R)-1-[(S)-cyano(phenyl)methyl]-3-methyl-butyl]carbamate CAS Name: N-[(1S,2R)-1-cyano-4-methyl-1-phenylpentan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(1S,2R)-1-cyano-4-methyl-1-phenylpentan-2-yl]carbamate Traditional Name: N-[(1R)-1-[(S)-cyano(phenyl)methyl]-3-methyl-butyl]carbamic acid benzyl ester Formula: C21H24N2O2 MolecularWeight: 336.42746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(C#N)C1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)C[C@H]([C@@H](C#N)C1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H24N2O2/c1-16(2)13-20(19(14-22)18-11-7-4-8-12-18)23-21(24)25-15-17-9-5-3-6-10-17/h3-12,16,19-20H,13,15H2,1-2H3,(H,23,24)/t19-,20+/m0/s1