[1-[(1-cyano-2-phenylmethoxy-ethyl)-methyl-carbamoyl]cyclohexyl] N-(phenylmethyl)carbamate

Systemtic Name: [1-[(1-cyano-2-phenylmethoxy-ethyl)-methyl-carbamoyl]cyclohexyl] N-(phenylmethyl)carbamate Openeye Name: [1-[(2-benzyloxy-1-cyano-ethyl)-methyl-carbamoyl]cyclohexyl] N-benzylcarbamate CAS Name: N-(phenylmethyl)carbamic acid [1-[[(1-cyano-2-phenylmethoxyethyl)-methylamino]-oxomethyl]cyclohexyl] ester IUPAC Name: [1-[(1-cyano-2-phenylmethoxyethyl)-methylcarbamoyl]cyclohexyl] N-benzylcarbamate Traditional Name: N-benzylcarbamic acid [1-[(2-benzoxy-1-cyano-ethyl)-methyl-carbamoyl]cyclohexyl] ester Formula: C26H31N3O4 MolecularWeight: 449.54204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C(COCC1=CC=CC=C1)C#N)C(=O)C2(CCCCC2)OC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CN(C(COCC1=CC=CC=C1)C#N)C(=O)C2(CCCCC2)OC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C26H31N3O4/c1-29(23(17-27)20-32-19-22-13-7-3-8-14-22)24(30)26(15-9-4-10-16-26)33-25(31)28-18-21-11-5-2-6-12-21/h2-3,5-8,11-14,23H,4,9-10,15-16,18-20H2,1H3,(H,28,31)