1,6-diisocyanato-2,2,4-trimethyl-hexane; 1,6-diisocyanato-2,4,4-trimethyl-hexane

Systemtic Name: 1,6-diisocyanato-2,2,4-trimethyl-hexane; 1,6-diisocyanato-2,4,4-trimethyl-hexane Openeye Name: 1,6-diisocyanato-2,2,4-trimethyl-hexane; 1,6-diisocyanato-2,4,4-trimethyl-hexane CAS Name: 1,6-diisocyanato-2,2,4-trimethylhexane; 1,6-diisocyanato-2,4,4-trimethylhexane IUPAC Name: 1,6-diisocyanato-2,2,4-trimethylhexane; 1,6-diisocyanato-2,4,4-trimethylhexane Traditional Name: 1,6-diisocyanato-2,2,4-trimethyl-hexane; 1,6-diisocyanato-2,4,4-trimethyl-hexane Formula: C22H36N4O4 MolecularWeight: 420.54564

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCN=C=O)CC(C)(C)CN=C=O.CC(CC(C)(C)CCN=C=O)CN=C=O

Isomeric SMILES

CC(CCN=C=O)CC(C)(C)CN=C=O.CC(CC(C)(C)CCN=C=O)CN=C=O

InChI

InChI=1S/2C11H18N2O2/c1-10(7-13-9-15)6-11(2,3)4-5-12-8-14;1-10(4-5-12-8-14)6-11(2,3)7-13-9-15/h2*10H,4-7H2,1-3H3