[2,2-bis(acetyloxymethyl)-3-henicosoxy-propyl] docosanoate

Systemtic Name: [2,2-bis(acetyloxymethyl)-3-henicosoxy-propyl] docosanoate Openeye Name: [2,2-bis(acetoxymethyl)-3-henicosoxy-propyl] docosanoate CAS Name: docosanoic acid [2,2-bis(acetyloxymethyl)-3-heneicosoxypropyl] ester IUPAC Name: [2,2-bis(acetyloxymethyl)-3-henicosoxypropyl] docosanoate Traditional Name: behenic acid [2,2-bis(acetoxymethyl)-3-heneicosoxy-propyl] ester Formula: C52H100O7 MolecularWeight: 837.3462

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)OCC(COCCCCCCCCCCCCCCCCCCCCC)(COC(=O)C)COC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)OCC(COCCCCCCCCCCCCCCCCCCCCC)(COC(=O)C)COC(=O)C

InChI

InChI=1S/C52H100O7/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-51(55)59-48-52(46-57-49(3)53,47-58-50(4)54)45-56-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2/h5-48H2,1-4H3