(5-isocyanato-1,3,3-trimethyl-cyclohexyl)methyl cyanate

Systemtic Name: (5-isocyanato-1,3,3-trimethyl-cyclohexyl)methyl cyanate Openeye Name: (5-isocyanato-1,3,3-trimethyl-cyclohexyl)methyl cyanate CAS Name: cyanic acid (5-isocyanato-1,3,3-trimethylcyclohexyl)methyl ester IUPAC Name: (5-isocyanato-1,3,3-trimethylcyclohexyl)methyl cyanate Traditional Name: cyanic acid (5-isocyanato-1,3,3-trimethyl-cyclohexyl)methyl ester Formula: C12H18N2O2 MolecularWeight: 222.28352

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC(C1)(C)COC#N)N=C=O)C

Isomeric SMILES

CC1(CC(CC(C1)(C)COC#N)N=C=O)C

InChI

InChI=1S/C12H18N2O2/c1-11(2)4-10(14-9-15)5-12(3,6-11)7-16-8-13/h10H,4-7H2,1-3H3