sodium 5-[(E)-(pyridin-3-ylcarbonylhydrazinylidene)methyl]furan-2-sulfonate

Systemtic Name: sodium 5-[(E)-(pyridin-3-ylcarbonylhydrazinylidene)methyl]furan-2-sulfonate Openeye Name: sodium 5-[(E)-(pyridine-3-carbonylhydrazono)methyl]furan-2-sulfonate CAS Name: sodium 5-[(E)-[[oxo(3-pyridinyl)methyl]hydrazinylidene]methyl]-2-furansulfonate IUPAC Name: sodium 5-[(E)-(pyridine-3-carbonylhydrazinylidene)methyl]furan-2-sulfonate Traditional Name: sodium 5-[(E)-(nicotinoylhydrazono)methyl]furan-2-sulfonate Formula: C11H8N3NaO5S MolecularWeight: 317.25309

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(=O)NN=CC2=CC=C(O2)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

C1=CC(=CN=C1)C(=O)N/N=C/C2=CC=C(O2)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C11H9N3O5S.Na/c15-11(8-2-1-5-12-6-8)14-13-7-9-3-4-10(19-9)20(16,17)18;/h1-7H,(H,14,15)(H,16,17,18);/q;+1/p-1/b13-7+;