ethyl 3-methyl-3-(5-methylsulfonyloxypentylsulfanyl)butanoate

Systemtic Name: ethyl 3-methyl-3-(5-methylsulfonyloxypentylsulfanyl)butanoate Openeye Name: ethyl 3-methyl-3-(5-methylsulfonyloxypentylsulfanyl)butanoate CAS Name: 3-methyl-3-(5-methylsulfonyloxypentylthio)butanoic acid ethyl ester IUPAC Name: ethyl 3-methyl-3-(5-methylsulfonyloxypentylsulfanyl)butanoate Traditional Name: 3-methyl-3-(5-methylsulfonyloxypentylthio)butyric acid ethyl ester Formula: C13H26O5S2 MolecularWeight: 326.47254

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C)(C)SCCCCCOS(=O)(=O)C

Isomeric SMILES

CCOC(=O)CC(C)(C)SCCCCCOS(=O)(=O)C

InChI

InChI=1S/C13H26O5S2/c1-5-17-12(14)11-13(2,3)19-10-8-6-7-9-18-20(4,15)16/h5-11H2,1-4H3