[3-[3-(3-hexylsulfanylpropanoyloxy)-2-methyl-butan-2-yl]peroxy-3-methyl-butan-2-yl] 3-hexylsulfanylpropanoate

Systemtic Name: [3-[3-(3-hexylsulfanylpropanoyloxy)-2-methyl-butan-2-yl]peroxy-3-methyl-butan-2-yl] 3-hexylsulfanylpropanoate Openeye Name: [2-[2-(3-hexylsulfanylpropanoyloxy)-1,1-dimethyl-propyl]peroxy-1,2-dimethyl-propyl] 3-hexylsulfanylpropanoate CAS Name: 3-(hexylthio)propanoic acid [3-[3-[3-(hexylthio)-1-oxopropoxy]-2-methylbutan-2-yl]dioxy-3-methylbutan-2-yl] ester IUPAC Name: [3-[3-(3-hexylsulfanylpropanoyloxy)-2-methylbutan-2-yl]peroxy-3-methylbutan-2-yl] 3-hexylsulfanylpropanoate Traditional Name: 3-(hexylthio)propionic acid [2-[2-[3-(hexylthio)propanoyloxy]-1,1-dimethyl-propyl]peroxy-1,2-dimethyl-propyl] ester Formula: C28H54O6S2 MolecularWeight: 550.85476

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSCCC(=O)OC(C)C(C)(C)OOC(C)(C)C(C)OC(=O)CCSCCCCCC

Isomeric SMILES

CCCCCCSCCC(=O)OC(C)C(C)(C)OOC(C)(C)C(C)OC(=O)CCSCCCCCC

InChI

InChI=1S/C28H54O6S2/c1-9-11-13-15-19-35-21-17-25(29)31-23(3)27(5,6)33-34-28(7,8)24(4)32-26(30)18-22-36-20-16-14-12-10-2/h23-24H,9-22H2,1-8H3