1,3-di(henicosoxy)propan-2-yl docosanoate

Systemtic Name: 1,3-di(henicosoxy)propan-2-yl docosanoate Openeye Name: [2-henicosoxy-1-(henicosoxymethyl)ethyl] docosanoate CAS Name: docosanoic acid 1,3-di(heneicosoxy)propan-2-yl ester IUPAC Name: 1,3-di(henicosoxy)propan-2-yl docosanoate Traditional Name: behenic acid [2-heneicosoxy-1-(heneicosoxymethyl)ethyl] ester Formula: C67H134O4 MolecularWeight: 1003.77846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)OC(COCCCCCCCCCCCCCCCCCCCCC)COCCCCCCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)OC(COCCCCCCCCCCCCCCCCCCCCC)COCCCCCCCCCCCCCCCCCCCCC

InChI

InChI=1S/C67H134O4/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-52-55-58-61-67(68)71-66(64-69-62-59-56-53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2)65-70-63-60-57-54-51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3/h66H,4-65H2,1-3H3