3,7-diisocyanatononan-5-ylbenzene

Systemtic Name: 3,7-diisocyanatononan-5-ylbenzene Openeye Name: [3-isocyanato-1-(2-isocyanatobutyl)pentyl]benzene CAS Name: 3,7-diisocyanatononan-5-ylbenzene IUPAC Name: 3,7-diisocyanatononan-5-ylbenzene Traditional Name: [3-isocyanato-1-(2-isocyanatobutyl)pentyl]benzene Formula: C17H22N2O2 MolecularWeight: 286.36878

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(CC(CC)N=C=O)C1=CC=CC=C1)N=C=O

Isomeric SMILES

CCC(CC(CC(CC)N=C=O)C1=CC=CC=C1)N=C=O

InChI

InChI=1S/C17H22N2O2/c1-3-16(18-12-20)10-15(11-17(4-2)19-13-21)14-8-6-5-7-9-14/h5-9,15-17H,3-4,10-11H2,1-2H3