sodium 4-[(2E)-2-(5-oxidanylidene-1-phenyl-1,2,3-triazol-4-ylidene)hydrazinyl]benzenesulfonate

Systemtic Name: sodium 4-[(2E)-2-(5-oxidanylidene-1-phenyl-1,2,3-triazol-4-ylidene)hydrazinyl]benzenesulfonate Openeye Name: sodium 4-[(2E)-2-(5-oxo-1-phenyl-triazol-4-ylidene)hydrazino]benzenesulfonate CAS Name: sodium 4-[(2E)-2-(5-oxo-1-phenyl-4-triazolylidene)hydrazinyl]benzenesulfonate IUPAC Name: sodium 4-[(2E)-2-(5-oxo-1-phenyltriazol-4-ylidene)hydrazinyl]benzenesulfonate Traditional Name: sodium 4-[(N'E)-N'-(5-keto-1-phenyl-triazol-4-ylidene)hydrazino]besylate Formula: C14H10N5NaO4S MolecularWeight: 367.31507

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(=NNC3=CC=C(C=C3)S(=O)(=O)[O-])N=N2.[Na+]

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)/C(=N\NC3=CC=C(C=C3)S(=O)(=O)[O-])/N=N2.[Na+]

InChI

InChI=1S/C14H11N5O4S.Na/c20-14-13(17-18-19(14)11-4-2-1-3-5-11)16-15-10-6-8-12(9-7-10)24(21,22)23;/h1-9,15H,(H,21,22,23);/q;+1/p-1/b16-13+;