[3-(3-decylsulfanylpropanoyloxy)-2,2-bis(3-decylsulfanylpropanoyloxymethyl)propyl] 3-decylsulfanylpropanoate

Systemtic Name: [3-(3-decylsulfanylpropanoyloxy)-2,2-bis(3-decylsulfanylpropanoyloxymethyl)propyl] 3-decylsulfanylpropanoate Openeye Name: [3-(3-decylsulfanylpropanoyloxy)-2,2-bis(3-decylsulfanylpropanoyloxymethyl)propyl] 3-decylsulfanylpropanoate CAS Name: 3-(decylthio)propanoic acid [3-[3-(decylthio)-1-oxopropoxy]-2,2-bis[[3-(decylthio)-1-oxopropoxy]methyl]propyl] ester IUPAC Name: [3-(3-decylsulfanylpropanoyloxy)-2,2-bis(3-decylsulfanylpropanoyloxymethyl)propyl] 3-decylsulfanylpropanoate Traditional Name: 3-(decylthio)propionic acid [3-[3-(decylthio)propanoyloxy]-2,2-bis[3-(decylthio)propanoyloxymethyl]propyl] ester Formula: C57H108O8S4 MolecularWeight: 1049.72262

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCSCCC(=O)OCC(COC(=O)CCSCCCCCCCCCC)(COC(=O)CCSCCCCCCCCCC)COC(=O)CCSCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCSCCC(=O)OCC(COC(=O)CCSCCCCCCCCCC)(COC(=O)CCSCCCCCCCCCC)COC(=O)CCSCCCCCCCCCC

InChI

InChI=1S/C57H108O8S4/c1-5-9-13-17-21-25-29-33-41-66-45-37-53(58)62-49-57(50-63-54(59)38-46-67-42-34-30-26-22-18-14-10-6-2,51-64-55(60)39-47-68-43-35-31-27-23-19-15-11-7-3)52-65-56(61)40-48-69-44-36-32-28-24-20-16-12-8-4/h5-52H2,1-4H3