5-isocyanato-1-(1-isocyanatoethyl)-1,3,3-trimethyl-cyclohexane

Systemtic Name: 5-isocyanato-1-(1-isocyanatoethyl)-1,3,3-trimethyl-cyclohexane Openeye Name: 5-isocyanato-1-(1-isocyanatoethyl)-1,3,3-trimethyl-cyclohexane CAS Name: 5-isocyanato-1-(1-isocyanatoethyl)-1,3,3-trimethylcyclohexane IUPAC Name: 5-isocyanato-1-(1-isocyanatoethyl)-1,3,3-trimethylcyclohexane Traditional Name: 5-isocyanato-1-(1-isocyanatoethyl)-1,3,3-trimethyl-cyclohexane Formula: C13H20N2O2 MolecularWeight: 236.3101

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1(CC(CC(C1)(C)C)N=C=O)C)N=C=O

Isomeric SMILES

CC(C1(CC(CC(C1)(C)C)N=C=O)C)N=C=O

InChI

InChI=1S/C13H20N2O2/c1-10(14-8-16)13(4)6-11(15-9-17)5-12(2,3)7-13/h10-11H,5-7H2,1-4H3