(phenylmethyl) N-[(2S)-1-(cyanomethylamino)-3,3-dimethyl-1-oxidanylidene-butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-(cyanomethylamino)-3,3-dimethyl-1-oxidanylidene-butan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-(cyanomethylcarbamoyl)-2,2-dimethyl-propyl]carbamate CAS Name: N-[(2S)-1-(cyanomethylamino)-3,3-dimethyl-1-oxobutan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-(cyanomethylamino)-3,3-dimethyl-1-oxobutan-2-yl]carbamate Traditional Name: N-[(1S)-1-(cyanomethylcarbamoyl)-2,2-dimethyl-propyl]carbamic acid benzyl ester Formula: C16H21N3O3 MolecularWeight: 303.35624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N3O3/c1-16(2,3)13(14(20)18-10-9-17)19-15(21)22-11-12-7-5-4-6-8-12/h4-8,13H,10-11H2,1-3H3,(H,18,20)(H,19,21)/t13-/m1/s1