(phenylmethyl) N-[(2S)-1-[[(1S)-1-cyanoethyl]-methyl-amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-[[(1S)-1-cyanoethyl]-methyl-amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-benzyl-2-[[(1S)-1-cyanoethyl]-methyl-amino]-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-1-[[(1S)-1-cyanoethyl]-methylamino]-1-oxo-3-phenylpropan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-[[(1S)-1-cyanoethyl]-methylamino]-1-oxo-3-phenylpropan-2-yl]carbamate Traditional Name: N-[(1S)-1-benzyl-2-[[(1S)-1-cyanoethyl]-methyl-amino]-2-keto-ethyl]carbamic acid benzyl ester Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)N(C)C(=O)C(CC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C#N)N(C)C(=O)[C@H](CC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H23N3O3/c1-16(14-22)24(2)20(25)19(13-17-9-5-3-6-10-17)23-21(26)27-15-18-11-7-4-8-12-18/h3-12,16,19H,13,15H2,1-2H3,(H,23,26)/t16-,19-/m0/s1