(phenylmethyl) N-[(2S)-1-[(2S)-2-cyanopyrrolidin-1-yl]-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-[(2S)-2-cyanopyrrolidin-1-yl]-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-2-[(2S)-2-cyanopyrrolidin-1-yl]-1-methyl-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-1-[(2S)-2-cyano-1-pyrrolidinyl]-1-oxopropan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-[(2S)-2-cyanopyrrolidin-1-yl]-1-oxopropan-2-yl]carbamate Traditional Name: N-[(1S)-2-[(2S)-2-cyanopyrrolidino]-2-keto-1-methyl-ethyl]carbamic acid benzyl ester Formula: C16H19N3O3 MolecularWeight: 301.34036

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1C#N)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)N1CCC[C@H]1C#N)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C16H19N3O3/c1-12(15(20)19-9-5-8-14(19)10-17)18-16(21)22-11-13-6-3-2-4-7-13/h2-4,6-7,12,14H,5,8-9,11H2,1H3,(H,18,21)/t12-,14-/m0/s1