sodium 4-[(4-nitrophenyl)amino]benzenesulfonate

Systemtic Name: sodium 4-[(4-nitrophenyl)amino]benzenesulfonate Openeye Name: sodium 4-(4-nitroanilino)benzenesulfonate CAS Name: sodium 4-(4-nitroanilino)benzenesulfonate IUPAC Name: sodium 4-(4-nitroanilino)benzenesulfonate Traditional Name: sodium 4-(4-nitroanilino)besylate Formula: C12H9N2NaO5S MolecularWeight: 316.26503

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=CC=C(C=C2)S(=O)(=O)[O-])[N+](=O)[O-].[Na+]

Isomeric SMILES

C1=CC(=CC=C1NC2=CC=C(C=C2)S(=O)(=O)[O-])[N+](=O)[O-].[Na+]

InChI

InChI=1S/C12H10N2O5S.Na/c15-14(16)11-5-1-9(2-6-11)13-10-3-7-12(8-4-10)20(17,18)19;/h1-8,13H,(H,17,18,19);/q;+1/p-1