(2,7-diisocyanato-1-phenyl-heptyl)benzene

Systemtic Name: (2,7-diisocyanato-1-phenyl-heptyl)benzene Openeye Name: (2,7-diisocyanato-1-phenyl-heptyl)benzene CAS Name: (2,7-diisocyanato-1-phenylheptyl)benzene IUPAC Name: (2,7-diisocyanato-1-phenylheptyl)benzene Traditional Name: (2,7-diisocyanato-1-phenyl-heptyl)benzene Formula: C21H22N2O2 MolecularWeight: 334.41158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)C(CCCCCN=C=O)N=C=O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)C(CCCCCN=C=O)N=C=O

InChI

InChI=1S/C21H22N2O2/c24-16-22-15-9-3-8-14-20(23-17-25)21(18-10-4-1-5-11-18)19-12-6-2-7-13-19/h1-2,4-7,10-13,20-21H,3,8-9,14-15H2