[3-(3-dodecan-2-ylsulfanylpropanoyloxy)-2,2-bis(3-dodecan-2-ylsulfanylpropanoyloxymethyl)propyl] 3-dodecan-2-ylsulfanylpropanoate

Systemtic Name: [3-(3-dodecan-2-ylsulfanylpropanoyloxy)-2,2-bis(3-dodecan-2-ylsulfanylpropanoyloxymethyl)propyl] 3-dodecan-2-ylsulfanylpropanoate Openeye Name: [3-[3-(1-methylundecylsulfanyl)propanoyloxy]-2,2-bis[3-(1-methylundecylsulfanyl)propanoyloxymethyl]propyl] 3-(1-methylundecylsulfanyl)propanoate CAS Name: 3-(dodecan-2-ylthio)propanoic acid [3-[3-(dodecan-2-ylthio)-1-oxopropoxy]-2,2-bis[[3-(dodecan-2-ylthio)-1-oxopropoxy]methyl]propyl] ester IUPAC Name: [3-(3-dodecan-2-ylsulfanylpropanoyloxy)-2,2-bis(3-dodecan-2-ylsulfanylpropanoyloxymethyl)propyl] 3-dodecan-2-ylsulfanylpropanoate Traditional Name: 3-(1-methylundecylthio)propionic acid [3-[3-(1-methylundecylthio)propanoyloxy]-2,2-bis[3-(1-methylundecylthio)propanoyloxymethyl]propyl] ester Formula: C65H124O8S4 MolecularWeight: 1161.93526

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(C)SCCC(=O)OCC(COC(=O)CCSC(C)CCCCCCCCCC)(COC(=O)CCSC(C)CCCCCCCCCC)COC(=O)CCSC(C)CCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCC(C)SCCC(=O)OCC(COC(=O)CCSC(C)CCCCCCCCCC)(COC(=O)CCSC(C)CCCCCCCCCC)COC(=O)CCSC(C)CCCCCCCCCC

InChI

InChI=1S/C65H124O8S4/c1-9-13-17-21-25-29-33-37-41-57(5)74-49-45-61(66)70-53-65(54-71-62(67)46-50-75-58(6)42-38-34-30-26-22-18-14-10-2,55-72-63(68)47-51-76-59(7)43-39-35-31-27-23-19-15-11-3)56-73-64(69)48-52-77-60(8)44-40-36-32-28-24-20-16-12-4/h57-60H,9-56H2,1-8H3