cyclohexyl N-[N-[1-(cyanomethylamino)-4,4-dimethyl-1-oxidanylidene-pentan-2-yl]-C-phenyl-carbonimidoyl]carbamate

Systemtic Name: cyclohexyl N-[N-[1-(cyanomethylamino)-4,4-dimethyl-1-oxidanylidene-pentan-2-yl]-C-phenyl-carbonimidoyl]carbamate Openeye Name: cyclohexyl N-[N-[1-(cyanomethylcarbamoyl)-3,3-dimethyl-butyl]-C-phenyl-carbonimidoyl]carbamate CAS Name: N-[[1-(cyanomethylamino)-4,4-dimethyl-1-oxopentan-2-yl]imino-phenylmethyl]carbamic acid cyclohexyl ester IUPAC Name: cyclohexyl N-[N-[1-(cyanomethylamino)-4,4-dimethyl-1-oxopentan-2-yl]-C-phenylcarbonimidoyl]carbamate Traditional Name: N-[N-[1-(cyanomethylcarbamoyl)-3,3-dimethyl-butyl]-C-phenyl-carbonimidoyl]carbamic acid cyclohexyl ester Formula: C23H32N4O3 MolecularWeight: 412.52518

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C(=O)NCC#N)N=C(C1=CC=CC=C1)NC(=O)OC2CCCCC2

Isomeric SMILES

CC(C)(C)CC(C(=O)NCC#N)N=C(C1=CC=CC=C1)NC(=O)OC2CCCCC2

InChI

InChI=1S/C23H32N4O3/c1-23(2,3)16-19(21(28)25-15-14-24)26-20(17-10-6-4-7-11-17)27-22(29)30-18-12-8-5-9-13-18/h4,6-7,10-11,18-19H,5,8-9,12-13,15-16H2,1-3H3,(H,25,28)(H,26,27,29)