[3-(4-decylsulfanylbutanoyloxy)-2,2-bis(4-decylsulfanylbutanoyloxymethyl)propyl] 4-decylsulfanylbutanoate

Systemtic Name: [3-(4-decylsulfanylbutanoyloxy)-2,2-bis(4-decylsulfanylbutanoyloxymethyl)propyl] 4-decylsulfanylbutanoate Openeye Name: [3-(4-decylsulfanylbutanoyloxy)-2,2-bis(4-decylsulfanylbutanoyloxymethyl)propyl] 4-decylsulfanylbutanoate CAS Name: 4-(decylthio)butanoic acid [3-[4-(decylthio)-1-oxobutoxy]-2,2-bis[[4-(decylthio)-1-oxobutoxy]methyl]propyl] ester IUPAC Name: [3-(4-decylsulfanylbutanoyloxy)-2,2-bis(4-decylsulfanylbutanoyloxymethyl)propyl] 4-decylsulfanylbutanoate Traditional Name: 4-(decylthio)butyric acid [3-[4-(decylthio)butanoyloxy]-2,2-bis[4-(decylthio)butanoyloxymethyl]propyl] ester Formula: C61H116O8S4 MolecularWeight: 1105.82894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCSCCCC(=O)OCC(COC(=O)CCCSCCCCCCCCCC)(COC(=O)CCCSCCCCCCCCCC)COC(=O)CCCSCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCSCCCC(=O)OCC(COC(=O)CCCSCCCCCCCCCC)(COC(=O)CCCSCCCCCCCCCC)COC(=O)CCCSCCCCCCCCCC

InChI

InChI=1S/C61H116O8S4/c1-5-9-13-17-21-25-29-33-45-70-49-37-41-57(62)66-53-61(54-67-58(63)42-38-50-71-46-34-30-26-22-18-14-10-6-2,55-68-59(64)43-39-51-72-47-35-31-27-23-19-15-11-7-3)56-69-60(65)44-40-52-73-48-36-32-28-24-20-16-12-8-4/h5-56H2,1-4H3