(3-butylsulfanyl-4-methylsulfonyloxy-butyl) methanesulfonate

Systemtic Name: (3-butylsulfanyl-4-methylsulfonyloxy-butyl) methanesulfonate Openeye Name: (3-butylsulfanyl-4-methylsulfonyloxy-butyl) methanesulfonate CAS Name: methanesulfonic acid [3-(butylthio)-4-methylsulfonyloxybutyl] ester IUPAC Name: (3-butylsulfanyl-4-methylsulfonyloxybutyl) methanesulfonate Traditional Name: methanesulfonic acid [3-(butylthio)-4-methylsulfonyloxy-butyl] ester Formula: C20H44O12S6 MolecularWeight: 668.94616

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC(CCOS(=O)(=O)C)COS(=O)(=O)C.CCCCSC(CCOS(=O)(=O)C)COS(=O)(=O)C

Isomeric SMILES

CCCCSC(CCOS(=O)(=O)C)COS(=O)(=O)C.CCCCSC(CCOS(=O)(=O)C)COS(=O)(=O)C

InChI

InChI=1S/2C10H22O6S3/c2*1-4-5-8-17-10(9-16-19(3,13)14)6-7-15-18(2,11)12/h2*10H,4-9H2,1-3H3