4-isocyanato-2-(isocyanatomethyl)-1-octyl-benzene

Systemtic Name: 4-isocyanato-2-(isocyanatomethyl)-1-octyl-benzene Openeye Name: 4-isocyanato-2-(isocyanatomethyl)-1-octyl-benzene CAS Name: 4-isocyanato-2-(isocyanatomethyl)-1-octylbenzene IUPAC Name: 4-isocyanato-2-(isocyanatomethyl)-1-octylbenzene Traditional Name: 4-isocyanato-2-(isocyanatomethyl)-1-octyl-benzene Formula: C17H22N2O2 MolecularWeight: 286.36878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(C=C(C=C1)N=C=O)CN=C=O

Isomeric SMILES

CCCCCCCCC1=C(C=C(C=C1)N=C=O)CN=C=O

InChI

InChI=1S/C17H22N2O2/c1-2-3-4-5-6-7-8-15-9-10-17(19-14-21)11-16(15)12-18-13-20/h9-11H,2-8,12H2,1H3