[isocyanato-(3,3,5-trimethylcyclohexyl)methyl] cyanate

Systemtic Name: [isocyanato-(3,3,5-trimethylcyclohexyl)methyl] cyanate Openeye Name: [isocyanato-(3,3,5-trimethylcyclohexyl)methyl] cyanate CAS Name: cyanic acid [isocyanato-(3,3,5-trimethylcyclohexyl)methyl] ester IUPAC Name: [isocyanato-(3,3,5-trimethylcyclohexyl)methyl] cyanate Traditional Name: cyanic acid [isocyanato-(3,3,5-trimethylcyclohexyl)methyl] ester Formula: C12H18N2O2 MolecularWeight: 222.28352

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(C1)(C)C)C(N=C=O)OC#N

Isomeric SMILES

CC1CC(CC(C1)(C)C)C(N=C=O)OC#N

InChI

InChI=1S/C12H18N2O2/c1-9-4-10(6-12(2,3)5-9)11(14-8-15)16-7-13/h9-11H,4-6H2,1-3H3