sodium 1-(phenylcarbonylsulfanyl)ethanesulfonate

Systemtic Name: sodium 1-(phenylcarbonylsulfanyl)ethanesulfonate Openeye Name: sodium 1-benzoylsulfanylethanesulfonate CAS Name: sodium 1-(benzoylthio)ethanesulfonate IUPAC Name: sodium 1-benzoylsulfanylethanesulfonate Traditional Name: sodium 1-(benzoylthio)ethanesulfonate Formula: C9H9NaO4S2 MolecularWeight: 268.28513

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Descriptors Computed from Structure

Canonical SMILES:

CC(SC(=O)C1=CC=CC=C1)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CC(SC(=O)C1=CC=CC=C1)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C9H10O4S2.Na/c1-7(15(11,12)13)14-9(10)8-5-3-2-4-6-8;/h2-7H,1H3,(H,11,12,13);/q;+1/p-1