(phenylmethyl) N-[1-(cyanomethylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-(cyanomethylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]carbamate Openeye Name: benzyl N-[1-(cyanomethylcarbamoyl)-3-methyl-butyl]carbamate CAS Name: N-[1-(cyanomethylamino)-4-methyl-1-oxopentan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-(cyanomethylamino)-4-methyl-1-oxopentan-2-yl]carbamate Traditional Name: N-[1-(cyanomethylcarbamoyl)-3-methyl-butyl]carbamic acid benzyl ester Formula: C16H21N3O3 MolecularWeight: 303.35624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N3O3/c1-12(2)10-14(15(20)18-9-8-17)19-16(21)22-11-13-6-4-3-5-7-13/h3-7,12,14H,9-11H2,1-2H3,(H,18,20)(H,19,21)