5,6-diisocyanato-1,5-dimethyl-cyclohexa-1,3-diene; 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethyl-cyclohexane

Systemtic Name: 5,6-diisocyanato-1,5-dimethyl-cyclohexa-1,3-diene; 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethyl-cyclohexane Openeye Name: 5,6-diisocyanato-1,5-dimethyl-cyclohexa-1,3-diene; 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethyl-cyclohexane CAS Name: 5,6-diisocyanato-1,5-dimethylcyclohexa-1,3-diene; 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane IUPAC Name: 5,6-diisocyanato-1,5-dimethylcyclohexa-1,3-diene; 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane Traditional Name: 5,6-diisocyanato-1,5-dimethyl-cyclohexa-1,3-diene; 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethyl-cyclohexane Formula: C22H28N4O4 MolecularWeight: 412.48212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(C1N=C=O)(C)N=C=O.CC1(CC(CC(C1)(C)CN=C=O)N=C=O)C

Isomeric SMILES

CC1=CC=CC(C1N=C=O)(C)N=C=O.CC1(CC(CC(C1)(C)CN=C=O)N=C=O)C

InChI

InChI=1S/C12H18N2O2.C10H10N2O2/c1-11(2)4-10(14-9-16)5-12(3,6-11)7-13-8-15;1-8-4-3-5-10(2,12-7-14)9(8)11-6-13/h10H,4-7H2,1-3H3;3-5,9H,1-2H3