methyl 4-sulfanylpentane-2-sulfonate

Systemtic Name: methyl 4-sulfanylpentane-2-sulfonate Openeye Name: methyl 4-sulfanylpentane-2-sulfonate CAS Name: 4-mercapto-2-pentanesulfonic acid IUPAC Name: methyl 4-sulfanylpentane-2-sulfonate Traditional Name: 4-mercaptopentane-2-sulfonic acid methyl ester Formula: C6H14O3S2 MolecularWeight: 198.30356

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C)S(=O)(=O)OC)S

Isomeric SMILES

CC(CC(C)S(=O)(=O)OC)S

InChI

InChI=1S/C6H14O3S2/c1-5(10)4-6(2)11(7,8)9-3/h5-6,10H,4H2,1-3H3