[1-[(1-cyano-3-methyl-butyl)carbamoyl]cyclohexyl] N-(phenylmethyl)carbamate

Systemtic Name: [1-[(1-cyano-3-methyl-butyl)carbamoyl]cyclohexyl] N-(phenylmethyl)carbamate Openeye Name: [1-[(1-cyano-3-methyl-butyl)carbamoyl]cyclohexyl] N-benzylcarbamate CAS Name: N-(phenylmethyl)carbamic acid [1-[[(1-cyano-3-methylbutyl)amino]-oxomethyl]cyclohexyl] ester IUPAC Name: [1-[(1-cyano-3-methylbutyl)carbamoyl]cyclohexyl] N-benzylcarbamate Traditional Name: N-benzylcarbamic acid [1-[(1-cyano-3-methyl-butyl)carbamoyl]cyclohexyl] ester Formula: C21H29N3O3 MolecularWeight: 371.47326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C#N)NC(=O)C1(CCCCC1)OC(=O)NCC2=CC=CC=C2

Isomeric SMILES

CC(C)CC(C#N)NC(=O)C1(CCCCC1)OC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C21H29N3O3/c1-16(2)13-18(14-22)24-19(25)21(11-7-4-8-12-21)27-20(26)23-15-17-9-5-3-6-10-17/h3,5-6,9-10,16,18H,4,7-8,11-13,15H2,1-2H3,(H,23,26)(H,24,25)