[(E)-2,3-di(docosanoyloxy)prop-2-enyl] docosanoate

Systemtic Name: [(E)-2,3-di(docosanoyloxy)prop-2-enyl] docosanoate Openeye Name: [(E)-2,3-di(docosanoyloxy)allyl] docosanoate CAS Name: docosanoic acid [(E)-2,3-bis(1-oxodocosoxy)prop-2-enyl] ester IUPAC Name: [(E)-2,3-di(docosanoyloxy)prop-2-enyl] docosanoate Traditional Name: behenic acid [(E)-2,3-di(docosanoyloxy)allyl] ester Formula: C69H132O6 MolecularWeight: 1057.78278

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)OCC(=COC(=O)CCCCCCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)OC/C(=C\OC(=O)CCCCCCCCCCCCCCCCCCCCC)/OC(=O)CCCCCCCCCCCCCCCCCCCCC

InChI

InChI=1S/C69H132O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-52-55-58-61-67(70)73-64-66(75-69(72)63-60-57-54-51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)65-74-68(71)62-59-56-53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h64H,4-63,65H2,1-3H3/b66-64+