sodium (4-ethanoylphenyl)methanesulfonate

Systemtic Name: sodium (4-ethanoylphenyl)methanesulfonate Openeye Name: sodium (4-acetylphenyl)methanesulfonate CAS Name: sodium (4-acetylphenyl)methanesulfonate IUPAC Name: sodium (4-acetylphenyl)methanesulfonate Traditional Name: sodium (4-acetylphenyl)methanesulfonate Formula: C9H9NaO4S MolecularWeight: 236.22013

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H10O4S.Na/c1-7(10)9-4-2-8(3-5-9)6-14(11,12)13;/h2-5H,6H2,1H3,(H,11,12,13);/q;+1/p-1