(E)-2,2-bis(7-methyloctyl)octadec-9-enoate

Systemtic Name: (E)-2,2-bis(7-methyloctyl)octadec-9-enoate Openeye Name: (E)-2,2-bis(7-methyloctyl)octadec-9-enoate CAS Name: (E)-2,2-bis(7-methyloctyl)-9-octadecenoate IUPAC Name: (E)-2,2-bis(7-methyloctyl)octadec-9-enoate Traditional Name: (E)-2,2-bis(7-methyloctyl)octadec-9-enoate Formula: C36H69O2- MolecularWeight: 533.93186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCC(CCCCCCC(C)C)(CCCCCCC(C)C)C(=O)[O-]

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCC(CCCCCCC(C)C)(CCCCCCC(C)C)C(=O)[O-]

InChI

InChI=1S/C36H70O2/c1-6-7-8-9-10-11-12-13-14-15-16-17-20-25-30-36(35(37)38,31-26-21-18-23-28-33(2)3)32-27-22-19-24-29-34(4)5/h13-14,33-34H,6-12,15-32H2,1-5H3,(H,37,38)/p-1/b14-13+