4-acetamido-3,5-dimethyl-benzenesulfonic acid; sodium

Systemtic Name: 4-acetamido-3,5-dimethyl-benzenesulfonic acid; sodium Openeye Name: 4-acetamido-3,5-dimethyl-benzenesulfonic acid; sodium CAS Name: 4-acetamido-3,5-dimethylbenzenesulfonic acid; sodium IUPAC Name: 4-acetamido-3,5-dimethylbenzenesulfonic acid; sodium Traditional Name: 4-acetamido-3,5-dimethyl-besylic acid; sodium Formula: C10H13NNaO4S MolecularWeight: 266.26929

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC(=O)C)C)S(=O)(=O)O.[Na]

Isomeric SMILES

CC1=CC(=CC(=C1NC(=O)C)C)S(=O)(=O)O.[Na]

InChI

InChI=1S/C10H13NO4S.Na/c1-6-4-9(16(13,14)15)5-7(2)10(6)11-8(3)12;/h4-5H,1-3H3,(H,11,12)(H,13,14,15);