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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(C)SCC(C)C(=O)OCC(COC(=O)C(C)CSC(C)CCCCCCCCCC)(COC(=O)C(C)CSC(C)CCCCCCCCCC)COC(=O)C(C)CSC(C)CCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCC(C)SCC(C)C(=O)OCC(COC(=O)C(C)CSC(C)CCCCCCCCCC)(COC(=O)C(C)CSC(C)CCCCCCCCCC)COC(=O)C(C)CSC(C)CCCCCCCCCC

InChI

InChI=1S/C69H132O8S4/c1-13-17-21-25-29-33-37-41-45-61(9)78-49-57(5)65(70)74-53-69(54-75-66(71)58(6)50-79-62(10)46-42-38-34-30-26-22-18-14-2,55-76-67(72)59(7)51-80-63(11)47-43-39-35-31-27-23-19-15-3)56-77-68(73)60(8)52-81-64(12)48-44-40-36-32-28-24-20-16-4/h57-64H,13-56H2,1-12H3