(4-methylsulfonyloxy-2,3-disulfooxy-butyl) methanesulfonate

Systemtic Name: (4-methylsulfonyloxy-2,3-disulfooxy-butyl) methanesulfonate Openeye Name: (4-methylsulfonyloxy-2,3-disulfooxy-butyl) methanesulfonate CAS Name: methanesulfonic acid (4-methylsulfonyloxy-2,3-disulfooxybutyl) ester IUPAC Name: (4-methylsulfonyloxy-2,3-disulfooxybutyl) methanesulfonate Traditional Name: methanesulfonic acid (4-methylsulfonyloxy-2,3-disulfoxy-butyl) ester Formula: C6H14O14S4 MolecularWeight: 438.42696

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCC(C(COS(=O)(=O)C)OS(=O)(=O)O)OS(=O)(=O)O

Isomeric SMILES

CS(=O)(=O)OCC(C(COS(=O)(=O)C)OS(=O)(=O)O)OS(=O)(=O)O

InChI

InChI=1S/C6H14O14S4/c1-21(7,8)17-3-5(19-23(11,12)13)6(20-24(14,15)16)4-18-22(2,9)10/h5-6H,3-4H2,1-2H3,(H,11,12,13)(H,14,15,16)