1,6-diisocyanatohexane; 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene

Systemtic Name: 1,6-diisocyanatohexane; 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene Openeye Name: 1,6-diisocyanatohexane; 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene CAS Name: 1,6-diisocyanatohexane; 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene IUPAC Name: 1,6-diisocyanatohexane; 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene Traditional Name: 1,6-diisocyanatohexane; 1-isocyanato-4-(4-isocyanatobenzyl)benzene Formula: C23H22N4O4 MolecularWeight: 418.44518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C(CCCN=C=O)CCN=C=O

Isomeric SMILES

C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C(CCCN=C=O)CCN=C=O

InChI

InChI=1S/C15H10N2O2.C8H12N2O2/c18-10-16-14-5-1-12(2-6-14)9-13-3-7-15(8-4-13)17-11-19;11-7-9-5-3-1-2-4-6-10-8-12/h1-8H,9H2;1-6H2