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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCSC(C)CC(=O)OCC(COC(=O)CC(C)SCCCCCCCCCC)(COC(=O)CC(C)SCCCCCCCCCC)COC(=O)CC(C)SCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCSC(C)CC(=O)OCC(COC(=O)CC(C)SCCCCCCCCCC)(COC(=O)CC(C)SCCCCCCCCCC)COC(=O)CC(C)SCCCCCCCCCC

InChI

InChI=1S/C61H116O8S4/c1-9-13-17-21-25-29-33-37-41-70-53(5)45-57(62)66-49-61(50-67-58(63)46-54(6)71-42-38-34-30-26-22-18-14-10-2,51-68-59(64)47-55(7)72-43-39-35-31-27-23-19-15-11-3)52-69-60(65)48-56(8)73-44-40-36-32-28-24-20-16-12-4/h53-56H,9-52H2,1-8H3