3-methyl-4-oxidanylidene-butane-2-sulfonic acid

Systemtic Name: 3-methyl-4-oxidanylidene-butane-2-sulfonic acid Openeye Name: 3-methyl-4-oxo-butane-2-sulfonic acid CAS Name: 3-methyl-4-oxo-2-butanesulfonic acid IUPAC Name: 3-methyl-4-oxobutane-2-sulfonic acid Traditional Name: 4-keto-3-methyl-butane-2-sulfonic acid Formula: C5H10O4S MolecularWeight: 166.1955

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C5H10O4S/c1-4(3-6)5(2)10(7,8)9/h3-5H,1-2H3,(H,7,8,9)