1,1'-biphenyl; docosanoate

Systemtic Name: 1,1'-biphenyl; docosanoate Openeye Name: biphenyl; docosanoate CAS Name: 1,1'-biphenyl; docosanoate IUPAC Name: 1,1'-biphenyl; docosanoate Traditional Name: behenate; biphenyl Formula: C34H53O2- MolecularWeight: 493.78342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)[O-].C1=CC=C(C=C1)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)[O-].C1=CC=C(C=C1)C2=CC=CC=C2

InChI

InChI=1S/C22H44O2.C12H10/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24;1-3-7-11(8-4-1)12-9-5-2-6-10-12/h2-21H2,1H3,(H,23,24);1-10H/p-1