sodium 4-ethanoylsulfanylbutane-1-sulfonate

Systemtic Name: sodium 4-ethanoylsulfanylbutane-1-sulfonate Openeye Name: sodium 4-acetylsulfanylbutane-1-sulfonate CAS Name: sodium 4-(acetylthio)-1-butanesulfonate IUPAC Name: sodium 4-acetylsulfanylbutane-1-sulfonate Traditional Name: sodium 4-(acetylthio)butane-1-sulfonate Formula: C6H11NaO4S2 MolecularWeight: 234.26891

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCCCS(=O)(=O)[O-].[Na+]

Isomeric SMILES

CC(=O)SCCCCS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C6H12O4S2.Na/c1-6(7)11-4-2-3-5-12(8,9)10;/h2-5H2,1H3,(H,8,9,10);/q;+1/p-1