6-isocyanato-N,N-bis(phenylmethyl)hexan-1-amine

Systemtic Name: 6-isocyanato-N,N-bis(phenylmethyl)hexan-1-amine Openeye Name: N,N-dibenzyl-6-isocyanato-hexan-1-amine CAS Name: 6-isocyanato-N,N-bis(phenylmethyl)-1-hexanamine IUPAC Name: N,N-dibenzyl-6-isocyanatohexan-1-amine Traditional Name: dibenzyl(6-isocyanatohexyl)amine Formula: C21H26N2O MolecularWeight: 322.44394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCCCCCN=C=O)CC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)CN(CCCCCCN=C=O)CC2=CC=CC=C2

InChI

InChI=1S/C21H26N2O/c24-19-22-15-9-1-2-10-16-23(17-20-11-5-3-6-12-20)18-21-13-7-4-8-14-21/h3-8,11-14H,1-2,9-10,15-18H2