sodium (5Z)-5-[(5-nitro-2-oxidanyl-phenyl)hydrazinylidene]-6-oxidanylidene-naphthalene-2-sulfonate

Systemtic Name: sodium (5Z)-5-[(5-nitro-2-oxidanyl-phenyl)hydrazinylidene]-6-oxidanylidene-naphthalene-2-sulfonate Openeye Name: sodium (5Z)-5-[(2-hydroxy-5-nitro-phenyl)hydrazono]-6-oxo-naphthalene-2-sulfonate CAS Name: sodium (5Z)-5-[(2-hydroxy-5-nitrophenyl)hydrazinylidene]-6-oxo-2-naphthalenesulfonate IUPAC Name: sodium (5Z)-5-[(2-hydroxy-5-nitrophenyl)hydrazinylidene]-6-oxonaphthalene-2-sulfonate Traditional Name: sodium (5Z)-5-[(2-hydroxy-5-nitro-phenyl)hydrazono]-6-keto-naphthalene-2-sulfonate Formula: C16H10N3NaO7S MolecularWeight: 411.32127

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])NN=C2C3=C(C=CC2=O)C=C(C=C3)S(=O)(=O)[O-])O.[Na+]

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])N/N=C\2/C3=C(C=CC2=O)C=C(C=C3)S(=O)(=O)[O-])O.[Na+]

InChI

InChI=1S/C16H11N3O7S.Na/c20-14-6-2-10(19(22)23)8-13(14)17-18-16-12-4-3-11(27(24,25)26)7-9(12)1-5-15(16)21;/h1-8,17,20H,(H,24,25,26);/q;+1/p-1/b18-16-;