sodium 2-[(3-methylphenyl)carbamoyl]benzenesulfonate

Systemtic Name: sodium 2-[(3-methylphenyl)carbamoyl]benzenesulfonate Openeye Name: sodium 2-(m-tolylcarbamoyl)benzenesulfonate CAS Name: sodium 2-[(3-methylanilino)-oxomethyl]benzenesulfonate IUPAC Name: sodium 2-[(3-methylphenyl)carbamoyl]benzenesulfonate Traditional Name: sodium 2-(m-tolylcarbamoyl)besylate Formula: C14H12NNaO4S MolecularWeight: 313.30415

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C14H13NO4S.Na/c1-10-5-4-6-11(9-10)15-14(16)12-7-2-3-8-13(12)20(17,18)19;/h2-9H,1H3,(H,15,16)(H,17,18,19);/q;+1/p-1