2,5-bis[(E)-icos-11-enyl]hexanedioic acid

Systemtic Name: 2,5-bis[(E)-icos-11-enyl]hexanedioic acid Openeye Name: 2,5-bis[(E)-icos-11-enyl]hexanedioic acid CAS Name: 2,5-bis[(E)-eicos-11-enyl]hexanedioic acid IUPAC Name: 2,5-bis[(E)-icos-11-enyl]hexanedioic acid Traditional Name: 2,5-bis[(E)-eicos-11-enyl]adipic acid Formula: C46H86O4 MolecularWeight: 703.17264

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCCCC(CCC(CCCCCCCCCCC=CCCCCCCCC)C(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCCCC(C(=O)O)CCC(C(=O)O)CCCCCCCCCC/C=C/CCCCCCCC

InChI

InChI=1S/C46H86O4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-43(45(47)48)41-42-44(46(49)50)40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20,43-44H,3-16,21-42H2,1-2H3,(H,47,48)(H,49,50)/b19-17+,20-18+