1-hexyl-3,4-bis(8-isocyanatooctyl)-2-octyl-cyclohexane

Systemtic Name: 1-hexyl-3,4-bis(8-isocyanatooctyl)-2-octyl-cyclohexane Openeye Name: 1-hexyl-3,4-bis(8-isocyanatooctyl)-2-octyl-cyclohexane CAS Name: 1-hexyl-3,4-bis(8-isocyanatooctyl)-2-octylcyclohexane IUPAC Name: 1-hexyl-3,4-bis(8-isocyanatooctyl)-2-octylcyclohexane Traditional Name: 1-hexyl-3,4-bis(8-isocyanatooctyl)-2-octyl-cyclohexane Formula: C38H70N2O2 MolecularWeight: 586.9746

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1C(CCC(C1CCCCCCCCN=C=O)CCCCCCCCN=C=O)CCCCCC

Isomeric SMILES

CCCCCCCCC1C(CCC(C1CCCCCCCCN=C=O)CCCCCCCCN=C=O)CCCCCC

InChI

InChI=1S/C38H70N2O2/c1-3-5-7-9-15-21-27-37-35(25-19-8-6-4-2)29-30-36(26-20-14-10-12-17-23-31-39-33-41)38(37)28-22-16-11-13-18-24-32-40-34-42/h35-38H,3-32H2,1-2H3