methyl N-[3-(isocyanatomethyl)-3,5,5-trimethyl-cyclohexyl]carbamate

Systemtic Name: methyl N-[3-(isocyanatomethyl)-3,5,5-trimethyl-cyclohexyl]carbamate Openeye Name: methyl N-[3-(isocyanatomethyl)-3,5,5-trimethyl-cyclohexyl]carbamate CAS Name: N-[3-(isocyanatomethyl)-3,5,5-trimethylcyclohexyl]carbamic acid methyl ester IUPAC Name: methyl N-[3-(isocyanatomethyl)-3,5,5-trimethylcyclohexyl]carbamate Traditional Name: N-[3-(isocyanatomethyl)-3,5,5-trimethyl-cyclohexyl]carbamic acid methyl ester Formula: C13H22N2O3 MolecularWeight: 254.32538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC(C1)(C)CN=C=O)NC(=O)OC)C

Isomeric SMILES

CC1(CC(CC(C1)(C)CN=C=O)NC(=O)OC)C

InChI

InChI=1S/C13H22N2O3/c1-12(2)5-10(15-11(17)18-4)6-13(3,7-12)8-14-9-16/h10H,5-8H2,1-4H3,(H,15,17)