[3-(3-dodecylsulfanyl-2-methyl-propanoyl)oxy-2,2-bis[(3-dodecylsulfanyl-2-methyl-propanoyl)oxymethyl]propyl] 3-dodecylsulfanyl-2-methyl-propanoate

Systemtic Name: [3-(3-dodecylsulfanyl-2-methyl-propanoyl)oxy-2,2-bis[(3-dodecylsulfanyl-2-methyl-propanoyl)oxymethyl]propyl] 3-dodecylsulfanyl-2-methyl-propanoate Openeye Name: [3-(3-dodecylsulfanyl-2-methyl-propanoyl)oxy-2,2-bis[(3-dodecylsulfanyl-2-methyl-propanoyl)oxymethyl]propyl] 3-dodecylsulfanyl-2-methyl-propanoate CAS Name: 3-(dodecylthio)-2-methylpropanoic acid [3-[3-(dodecylthio)-2-methyl-1-oxopropoxy]-2,2-bis[[3-(dodecylthio)-2-methyl-1-oxopropoxy]methyl]propyl] ester IUPAC Name: [3-(3-dodecylsulfanyl-2-methylpropanoyl)oxy-2,2-bis[(3-dodecylsulfanyl-2-methylpropanoyl)oxymethyl]propyl] 3-dodecylsulfanyl-2-methylpropanoate Traditional Name: 3-(laurylthio)-2-methyl-propionic acid [3-[3-(laurylthio)-2-methyl-propanoyl]oxy-2,2-bis[[3-(laurylthio)-2-methyl-propanoyl]oxymethyl]propyl] ester Formula: C69H132O8S4 MolecularWeight: 1218.04158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSCC(C)C(=O)OCC(COC(=O)C(C)CSCCCCCCCCCCCC)(COC(=O)C(C)CSCCCCCCCCCCCC)COC(=O)C(C)CSCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCSCC(C)C(=O)OCC(COC(=O)C(C)CSCCCCCCCCCCCC)(COC(=O)C(C)CSCCCCCCCCCCCC)COC(=O)C(C)CSCCCCCCCCCCCC

InChI

InChI=1S/C69H132O8S4/c1-9-13-17-21-25-29-33-37-41-45-49-78-53-61(5)65(70)74-57-69(58-75-66(71)62(6)54-79-50-46-42-38-34-30-26-22-18-14-10-2,59-76-67(72)63(7)55-80-51-47-43-39-35-31-27-23-19-15-11-3)60-77-68(73)64(8)56-81-52-48-44-40-36-32-28-24-20-16-12-4/h61-64H,9-60H2,1-8H3