sodium 4-[(3-aminophenyl)carbonylamino]benzenesulfonate

Systemtic Name: sodium 4-[(3-aminophenyl)carbonylamino]benzenesulfonate Openeye Name: sodium 4-[(3-aminobenzoyl)amino]benzenesulfonate CAS Name: sodium 4-[[(3-aminophenyl)-oxomethyl]amino]benzenesulfonate IUPAC Name: sodium 4-[(3-aminobenzoyl)amino]benzenesulfonate Traditional Name: sodium 4-[(3-aminobenzoyl)amino]besylate Formula: C13H11N2NaO4S MolecularWeight: 314.29221

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N)C(=O)NC2=CC=C(C=C2)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

C1=CC(=CC(=C1)N)C(=O)NC2=CC=C(C=C2)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C13H12N2O4S.Na/c14-10-3-1-2-9(8-10)13(16)15-11-4-6-12(7-5-11)20(17,18)19;/h1-8H,14H2,(H,15,16)(H,17,18,19);/q;+1/p-1