sodium 2-methyl-3-oxidanylidene-3-phenyl-propane-1-sulfonic acid

Systemtic Name: sodium 2-methyl-3-oxidanylidene-3-phenyl-propane-1-sulfonic acid Openeye Name: sodium 2-methyl-3-oxo-3-phenyl-propane-1-sulfonic acid CAS Name: sodium 2-methyl-3-oxo-3-phenyl-1-propanesulfonic acid IUPAC Name: sodium 2-methyl-3-oxo-3-phenylpropane-1-sulfonic acid Traditional Name: sodium 3-keto-2-methyl-3-phenyl-propane-1-sulfonic acid Formula: C10H12NaO4S+ MolecularWeight: 251.25465

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H12O4S.Na/c1-8(7-15(12,13)14)10(11)9-5-3-2-4-6-9;/h2-6,8H,7H2,1H3,(H,12,13,14);/q;+1