1-isocyanato-4-(isocyanatomethyl)-5-methyl-4-propan-2-yl-hexane

Systemtic Name: 1-isocyanato-4-(isocyanatomethyl)-5-methyl-4-propan-2-yl-hexane Openeye Name: 1-isocyanato-4-(isocyanatomethyl)-4-isopropyl-5-methyl-hexane CAS Name: 1-isocyanato-4-(isocyanatomethyl)-5-methyl-4-propan-2-ylhexane IUPAC Name: 1-isocyanato-4-(isocyanatomethyl)-5-methyl-4-propan-2-ylhexane Traditional Name: 1-isocyanato-4-(isocyanatomethyl)-4-isopropyl-5-methyl-hexane Formula: C13H22N2O2 MolecularWeight: 238.32598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCN=C=O)(CN=C=O)C(C)C

Isomeric SMILES

CC(C)C(CCCN=C=O)(CN=C=O)C(C)C

InChI

InChI=1S/C13H22N2O2/c1-11(2)13(12(3)4,8-15-10-17)6-5-7-14-9-16/h11-12H,5-8H2,1-4H3