[5-(3-dodecylsulfanylpropanoylperoxy)-2,5-dimethyl-hex-3-yn-2-yl] 3-dodecylsulfanylpropaneperoxoate

Systemtic Name: [5-(3-dodecylsulfanylpropanoylperoxy)-2,5-dimethyl-hex-3-yn-2-yl] 3-dodecylsulfanylpropaneperoxoate Openeye Name: [4-(3-dodecylsulfanylpropanoylperoxy)-1,1,4-trimethyl-pent-2-ynyl] 3-dodecylsulfanylpropaneperoxoate CAS Name: 3-(dodecylthio)propaneperoxoic acid [5-[3-(dodecylthio)-1-oxopropyl]dioxy-2,5-dimethylhex-3-yn-2-yl] ester IUPAC Name: [5-(3-dodecylsulfanylpropanoylperoxy)-2,5-dimethylhex-3-yn-2-yl] 3-dodecylsulfanylpropaneperoxoate Traditional Name: 3-(laurylthio)peroxypropionic acid [4-[3-(laurylthio)propanoylperoxy]-1,1,4-trimethyl-pent-2-ynyl] ester Formula: C38H70O6S2 MolecularWeight: 687.0888

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSCCC(=O)OOC(C)(C)C#CC(C)(C)OOC(=O)CCSCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCSCCC(=O)OOC(C)(C)C#CC(C)(C)OOC(=O)CCSCCCCCCCCCCCC

InChI

InChI=1S/C38H70O6S2/c1-7-9-11-13-15-17-19-21-23-25-31-45-33-27-35(39)41-43-37(3,4)29-30-38(5,6)44-42-36(40)28-34-46-32-26-24-22-20-18-16-14-12-10-8-2/h7-28,31-34H2,1-6H3