sodium 5-ethanoylthiophene-2-sulfonate

Systemtic Name: sodium 5-ethanoylthiophene-2-sulfonate Openeye Name: sodium 5-acetylthiophene-2-sulfonate CAS Name: sodium 5-acetyl-2-thiophenesulfonate IUPAC Name: sodium 5-acetylthiophene-2-sulfonate Traditional Name: sodium 5-acetylthiophene-2-sulfonate Formula: C6H5NaO4S2 MolecularWeight: 228.22127

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(S1)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CC(=O)C1=CC=C(S1)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C6H6O4S2.Na/c1-4(7)5-2-3-6(11-5)12(8,9)10;/h2-3H,1H3,(H,8,9,10);/q;+1/p-1