[(2R)-1-(cyanomethylamino)-3-cyclohexyl-1-oxidanylidene-propan-2-yl] N-tert-butylcarbamate

Systemtic Name: [(2R)-1-(cyanomethylamino)-3-cyclohexyl-1-oxidanylidene-propan-2-yl] N-tert-butylcarbamate Openeye Name: [(1R)-2-(cyanomethylamino)-1-(cyclohexylmethyl)-2-oxo-ethyl] N-tert-butylcarbamate CAS Name: N-tert-butylcarbamic acid [(2R)-1-(cyanomethylamino)-3-cyclohexyl-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cyanomethylamino)-3-cyclohexyl-1-oxopropan-2-yl] N-tert-butylcarbamate Traditional Name: N-tert-butylcarbamic acid [(1R)-2-(cyanomethylamino)-1-(cyclohexylmethyl)-2-keto-ethyl] ester Formula: C16H27N3O3 MolecularWeight: 309.40388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)OC(CC1CCCCC1)C(=O)NCC#N

Isomeric SMILES

CC(C)(C)NC(=O)O[C@H](CC1CCCCC1)C(=O)NCC#N

InChI

InChI=1S/C16H27N3O3/c1-16(2,3)19-15(21)22-13(14(20)18-10-9-17)11-12-7-5-4-6-8-12/h12-13H,4-8,10-11H2,1-3H3,(H,18,20)(H,19,21)/t13-/m1/s1