4-methyl-5-oxidanyl-5-oxidanylidene-pentane-1-sulfinate

Systemtic Name: 4-methyl-5-oxidanyl-5-oxidanylidene-pentane-1-sulfinate Openeye Name: 5-hydroxy-4-methyl-5-oxo-pentane-1-sulfinate CAS Name: 5-hydroxy-4-methyl-5-oxo-1-pentanesulfinate IUPAC Name: 5-hydroxy-4-methyl-5-oxopentane-1-sulfinate Traditional Name: 5-hydroxy-5-keto-4-methyl-pentane-1-sulfinate Formula: C6H11O4S- MolecularWeight: 179.21414

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCS(=O)[O-])C(=O)O

Isomeric SMILES

CC(CCCS(=O)[O-])C(=O)O

InChI

InChI=1S/C6H12O4S/c1-5(6(7)8)3-2-4-11(9)10/h5H,2-4H2,1H3,(H,7,8)(H,9,10)/p-1