sodium 3-[[[2-(2-carboxyphenyl)hydrazinyl]-phenyl-methylidene]hydrazinylidene]-4-oxidanylidene-cyclohexa-1,5-diene-1-sulfonate

Systemtic Name: sodium 3-[[[2-(2-carboxyphenyl)hydrazinyl]-phenyl-methylidene]hydrazinylidene]-4-oxidanylidene-cyclohexa-1,5-diene-1-sulfonate Openeye Name: sodium 3-[[[2-(2-carboxyphenyl)hydrazino]-phenyl-methylene]hydrazono]-4-oxo-cyclohexa-1,5-diene-1-sulfonate CAS Name: sodium 3-[[[(2-carboxyphenyl)hydrazo]-phenylmethylidene]hydrazinylidene]-4-oxo-1-cyclohexa-1,5-dienesulfonate IUPAC Name: sodium 3-[[[2-(2-carboxyphenyl)hydrazinyl]-phenylmethylidene]hydrazinylidene]-4-oxocyclohexa-1,5-diene-1-sulfonate Traditional Name: sodium 3-[[[N'-(2-carboxyphenyl)hydrazino]-phenyl-methylene]hydrazono]-4-keto-cyclohexa-1,5-diene-1-sulfonate Formula: C20H15N4NaO6S MolecularWeight: 462.41107

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=NN=C2C=C(C=CC2=O)S(=O)(=O)[O-])NNC3=CC=CC=C3C(=O)O.[Na+]

Isomeric SMILES

C1=CC=C(C=C1)C(=NN=C2C=C(C=CC2=O)S(=O)(=O)[O-])NNC3=CC=CC=C3C(=O)O.[Na+]

InChI

InChI=1S/C20H16N4O6S.Na/c25-18-11-10-14(31(28,29)30)12-17(18)22-24-19(13-6-2-1-3-7-13)23-21-16-9-5-4-8-15(16)20(26)27;/h1-12,21H,(H,23,24)(H,26,27)(H,28,29,30);/q;+1/p-1