tert-butyl N-[(2R)-1-(cyanomethylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2R)-1-(cyanomethylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1R)-1-benzyl-2-(cyanomethylamino)-2-oxo-ethyl]carbamate CAS Name: N-[(2R)-1-(cyanomethylamino)-1-oxo-3-phenylpropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2R)-1-(cyanomethylamino)-1-oxo-3-phenylpropan-2-yl]carbamate Traditional Name: N-[(1R)-1-benzyl-2-(cyanomethylamino)-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C16H21N3O3 MolecularWeight: 303.35624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)NCC#N

Isomeric SMILES

CC(C)(C)OC(=O)N[C@H](CC1=CC=CC=C1)C(=O)NCC#N

InChI

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