sodium 3-nitro-4-phenylazanyl-benzenesulfonate

Systemtic Name: sodium 3-nitro-4-phenylazanyl-benzenesulfonate Openeye Name: sodium 4-anilino-3-nitro-benzenesulfonate CAS Name: sodium 4-anilino-3-nitrobenzenesulfonate IUPAC Name: sodium 4-anilino-3-nitrobenzenesulfonate Traditional Name: sodium 4-anilino-3-nitro-besylate Formula: C12H9N2NaO5S MolecularWeight: 316.26503

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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