sodium 2-[(E)-[(5-nitropyridin-2-yl)hydrazinylidene]methyl]benzenesulfonate

Systemtic Name: sodium 2-[(E)-[(5-nitropyridin-2-yl)hydrazinylidene]methyl]benzenesulfonate Openeye Name: sodium 2-[(E)-[(5-nitro-2-pyridyl)hydrazono]methyl]benzenesulfonate CAS Name: sodium 2-[(E)-[(5-nitro-2-pyridinyl)hydrazinylidene]methyl]benzenesulfonate IUPAC Name: sodium 2-[(E)-[(5-nitropyridin-2-yl)hydrazinylidene]methyl]benzenesulfonate Traditional Name: sodium 2-[(E)-[(5-nitro-2-pyridyl)hydrazono]methyl]besylate Formula: C12H9N4NaO5S MolecularWeight: 344.27843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=NNC2=NC=C(C=C2)[N+](=O)[O-])S(=O)(=O)[O-].[Na+]

Isomeric SMILES

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

InChI

InChI=1S/C12H10N4O5S.Na/c17-16(18)10-5-6-12(13-8-10)15-14-7-9-3-1-2-4-11(9)22(19,20)21;/h1-8H,(H,13,15)(H,19,20,21);/q;+1/p-1/b14-7+;