(E)-2,2-bis(7-methyloctyl)octadec-9-enoic acid

Systemtic Name: (E)-2,2-bis(7-methyloctyl)octadec-9-enoic acid Openeye Name: (E)-2,2-bis(7-methyloctyl)octadec-9-enoic acid CAS Name: (E)-2,2-bis(7-methyloctyl)-9-octadecenoic acid IUPAC Name: (E)-2,2-bis(7-methyloctyl)octadec-9-enoic acid Traditional Name: (E)-2,2-bis(7-methyloctyl)octadec-9-enoic acid Formula: C36H70O2 MolecularWeight: 534.9398

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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)/b14-13+