[3-(3-hexylsulfanylpropanoyloxy)-2,2-bis(3-hexylsulfanylpropanoyloxymethyl)propyl] 3-hexylsulfanylpropanoate

Systemtic Name: [3-(3-hexylsulfanylpropanoyloxy)-2,2-bis(3-hexylsulfanylpropanoyloxymethyl)propyl] 3-hexylsulfanylpropanoate Openeye Name: [3-(3-hexylsulfanylpropanoyloxy)-2,2-bis(3-hexylsulfanylpropanoyloxymethyl)propyl] 3-hexylsulfanylpropanoate CAS Name: 3-(hexylthio)propanoic acid [3-[3-(hexylthio)-1-oxopropoxy]-2,2-bis[[3-(hexylthio)-1-oxopropoxy]methyl]propyl] ester IUPAC Name: [3-(3-hexylsulfanylpropanoyloxy)-2,2-bis(3-hexylsulfanylpropanoyloxymethyl)propyl] 3-hexylsulfanylpropanoate Traditional Name: 3-(hexylthio)propionic acid [3-[3-(hexylthio)propanoyloxy]-2,2-bis[3-(hexylthio)propanoyloxymethyl]propyl] ester Formula: C41H76O8S4 MolecularWeight: 825.29734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSCCC(=O)OCC(COC(=O)CCSCCCCCC)(COC(=O)CCSCCCCCC)COC(=O)CCSCCCCCC

Isomeric SMILES

CCCCCCSCCC(=O)OCC(COC(=O)CCSCCCCCC)(COC(=O)CCSCCCCCC)COC(=O)CCSCCCCCC

InChI

InChI=1S/C41H76O8S4/c1-5-9-13-17-25-50-29-21-37(42)46-33-41(34-47-38(43)22-30-51-26-18-14-10-6-2,35-48-39(44)23-31-52-27-19-15-11-7-3)36-49-40(45)24-32-53-28-20-16-12-8-4/h5-36H2,1-4H3