4-methylsulfonylbutane-2-sulfinic acid

Systemtic Name: 4-methylsulfonylbutane-2-sulfinic acid Openeye Name: 4-methylsulfonylbutane-2-sulfinic acid CAS Name: 4-methylsulfonyl-2-butanesulfinic acid IUPAC Name: 4-methylsulfonylbutane-2-sulfinic acid Traditional Name: 4-mesylbutane-2-sulfinic acid Formula: C5H12O4S2 MolecularWeight: 200.27638

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCS(=O)(=O)C)S(=O)O

Isomeric SMILES

CC(CCS(=O)(=O)C)S(=O)O

InChI

InChI=1S/C5H12O4S2/c1-5(10(6)7)3-4-11(2,8)9/h5H,3-4H2,1-2H3,(H,6,7)