[(3-methylphenyl)amino]methanesulfonic acid; sodium

Systemtic Name: [(3-methylphenyl)amino]methanesulfonic acid; sodium Openeye Name: (3-methylanilino)methanesulfonic acid; sodium CAS Name: (3-methylanilino)methanesulfonic acid; sodium IUPAC Name: (3-methylanilino)methanesulfonic acid; sodium Traditional Name: m-toluidinomethanesulfonic acid; sodium Formula: C8H11NNaO3S MolecularWeight: 224.23261

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NCS(=O)(=O)O.[Na]

Isomeric SMILES

CC1=CC(=CC=C1)NCS(=O)(=O)O.[Na]

InChI

InChI=1S/C8H11NO3S.Na/c1-7-3-2-4-8(5-7)9-6-13(10,11)12;/h2-5,9H,6H2,1H3,(H,10,11,12);