[2-methyl-3-octacosanoyloxy-2-(octacosanoyloxymethyl)propyl] octacosanoate

Systemtic Name: [2-methyl-3-octacosanoyloxy-2-(octacosanoyloxymethyl)propyl] octacosanoate Openeye Name: [2-methyl-3-octacosanoyloxy-2-(octacosanoyloxymethyl)propyl] octacosanoate CAS Name: octacosanoic acid [2-methyl-3-(1-oxooctacosoxy)-2-(1-oxooctacosoxymethyl)propyl] ester IUPAC Name: [2-methyl-3-octacosanoyloxy-2-(octacosanoyloxymethyl)propyl] octacosanoate Traditional Name: montanic acid [2-methyl-3-octacosanoyloxy-2-(octacosanoyloxymethyl)propyl] ester Formula: C89H174O6 MolecularWeight: 1340.33026

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OCC(C)(COC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OCC(C)(COC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCC

InChI

InChI=1S/C89H174O6/c1-5-8-11-14-17-20-23-26-29-32-35-38-41-44-47-50-53-56-59-62-65-68-71-74-77-80-86(90)93-83-89(4,84-94-87(91)81-78-75-72-69-66-63-60-57-54-51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-2)85-95-88(92)82-79-76-73-70-67-64-61-58-55-52-49-46-43-40-37-34-31-28-25-22-19-16-13-10-7-3/h5-85H2,1-4H3