[3-propanoyloxy-2,2-bis(propanoyloxymethyl)propyl] octacosanoate

Systemtic Name: [3-propanoyloxy-2,2-bis(propanoyloxymethyl)propyl] octacosanoate Openeye Name: [3-propanoyloxy-2,2-bis(propanoyloxymethyl)propyl] octacosanoate CAS Name: octacosanoic acid [3-(1-oxopropoxy)-2,2-bis(1-oxopropoxymethyl)propyl] ester IUPAC Name: [3-propanoyloxy-2,2-bis(propanoyloxymethyl)propyl] octacosanoate Traditional Name: montanic acid [3-propionyloxy-2,2-bis(propionyloxymethyl)propyl] ester Formula: C42H78O8 MolecularWeight: 711.06392

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CC)(COC(=O)CC)COC(=O)CC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CC)(COC(=O)CC)COC(=O)CC

InChI

InChI=1S/C42H78O8/c1-5-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-41(46)50-37-42(34-47-38(43)6-2,35-48-39(44)7-3)36-49-40(45)8-4/h5-37H2,1-4H3