[3-octadecanoyloxy-2,2-bis(octadecanoyloxymethyl)propyl] cycloheptadecanecarboxylate

Systemtic Name: [3-octadecanoyloxy-2,2-bis(octadecanoyloxymethyl)propyl] cycloheptadecanecarboxylate Openeye Name: [3-octadecanoyloxy-2,2-bis(octadecanoyloxymethyl)propyl] cycloheptadecanecarboxylate CAS Name: cycloheptadecanecarboxylic acid [3-(1-oxooctadecoxy)-2,2-bis(1-oxooctadecoxymethyl)propyl] ester IUPAC Name: [3-octadecanoyloxy-2,2-bis(octadecanoyloxymethyl)propyl] cycloheptadecanecarboxylate Traditional Name: cycloheptadecanecarboxylic acid [3-stearoyloxy-2,2-bis(stearoyloxymethyl)propyl] ester Formula: C77H146O8 MolecularWeight: 1199.97834

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCC)(COC(=O)CCCCCCCCCCCCCCCCC)COC(=O)C1CCCCCCCCCCCCCCCC1

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCC)(COC(=O)CCCCCCCCCCCCCCCCC)COC(=O)C1CCCCCCCCCCCCCCCC1

InChI

InChI=1S/C77H146O8/c1-4-7-10-13-16-19-22-25-28-35-40-45-50-55-60-65-73(78)82-68-77(69-83-74(79)66-61-56-51-46-41-36-29-26-23-20-17-14-11-8-5-2,70-84-75(80)67-62-57-52-47-42-37-30-27-24-21-18-15-12-9-6-3)71-85-76(81)72-63-58-53-48-43-38-33-31-32-34-39-44-49-54-59-64-72/h72H,4-71H2,1-3H3