[3-[3,3-di(docosanoyloxy)propoxy]-1-oxidanyl-propyl] docosanoate

Systemtic Name: [3-[3,3-di(docosanoyloxy)propoxy]-1-oxidanyl-propyl] docosanoate Openeye Name: [3-[3,3-di(docosanoyloxy)propoxy]-1-hydroxy-propyl] docosanoate CAS Name: docosanoic acid [3-[3,3-bis(1-oxodocosoxy)propoxy]-1-hydroxypropyl] ester IUPAC Name: [3-[3,3-di(docosanoyloxy)propoxy]-1-hydroxypropyl] docosanoate Traditional Name: behenic acid [3-[3,3-di(docosanoyloxy)propoxy]-1-hydroxy-propyl] ester Formula: C72H140O8 MolecularWeight: 1133.8772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)OC(CCOCCC(OC(=O)CCCCCCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCCCC)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)OC(CCOCCC(OC(=O)CCCCCCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCCCC)O

InChI

InChI=1S/C72H140O8/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-52-55-58-61-68(73)78-71(76)64-66-77-67-65-72(79-69(74)62-59-56-53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2)80-70(75)63-60-57-54-51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3/h71-72,76H,4-67H2,1-3H3