3-isocyanato-5-(1-isocyanatopropan-2-yl)-1,1-dimethyl-cyclohexane

Systemtic Name: 3-isocyanato-5-(1-isocyanatopropan-2-yl)-1,1-dimethyl-cyclohexane Openeye Name: 3-isocyanato-5-(2-isocyanato-1-methyl-ethyl)-1,1-dimethyl-cyclohexane CAS Name: 3-isocyanato-5-(1-isocyanatopropan-2-yl)-1,1-dimethylcyclohexane IUPAC Name: 3-isocyanato-5-(1-isocyanatopropan-2-yl)-1,1-dimethylcyclohexane Traditional Name: 3-isocyanato-5-(2-isocyanato-1-methyl-ethyl)-1,1-dimethyl-cyclohexane Formula: C13H20N2O2 MolecularWeight: 236.3101

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN=C=O)C1CC(CC(C1)(C)C)N=C=O

Isomeric SMILES

CC(CN=C=O)C1CC(CC(C1)(C)C)N=C=O

InChI

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