sodium 4-oxidanylidene-4-sulfanyloxy-butanoate

Systemtic Name: sodium 4-oxidanylidene-4-sulfanyloxy-butanoate Openeye Name: sodium 4-oxo-4-sulfanyloxy-butanoate CAS Name: sodium 4-mercaptooxy-4-oxobutanoate IUPAC Name: sodium 4-oxo-4-sulfanyloxybutanoate Traditional Name: sodium 4-keto-4-mercaptooxy-butyrate Formula: C4H5NaO4S MolecularWeight: 172.13487

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(=O)OS)C(=O)[O-].[Na+]

Isomeric SMILES

C(CC(=O)OS)C(=O)[O-].[Na+]

InChI

InChI=1S/C4H6O4S.Na/c5-3(6)1-2-4(7)8-9;/h9H,1-2H2,(H,5,6);/q;+1/p-1