sodium (6Z)-6-[(5-nitro-2-oxidanyl-phenyl)hydrazinylidene]-5-oxidanylidene-naphthalene-1-sulfonate

Systemtic Name: sodium (6Z)-6-[(5-nitro-2-oxidanyl-phenyl)hydrazinylidene]-5-oxidanylidene-naphthalene-1-sulfonate Openeye Name: sodium (6Z)-6-[(2-hydroxy-5-nitro-phenyl)hydrazono]-5-oxo-naphthalene-1-sulfonate CAS Name: sodium (6Z)-6-[(2-hydroxy-5-nitrophenyl)hydrazinylidene]-5-oxo-1-naphthalenesulfonate IUPAC Name: sodium (6Z)-6-[(2-hydroxy-5-nitrophenyl)hydrazinylidene]-5-oxonaphthalene-1-sulfonate Traditional Name: sodium (6Z)-6-[(2-hydroxy-5-nitro-phenyl)hydrazono]-5-keto-naphthalene-1-sulfonate Formula: C16H10N3NaO7S MolecularWeight: 411.32127

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=NNC3=C(C=CC(=C3)[N+](=O)[O-])O)C2=O)C(=C1)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

C1=CC2=C(C=C/C(=N/NC3=C(C=CC(=C3)[N+](=O)[O-])O)/C2=O)C(=C1)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C16H11N3O7S.Na/c20-14-7-4-9(19(22)23)8-13(14)18-17-12-6-5-10-11(16(12)21)2-1-3-15(10)27(24,25)26;/h1-8,18,20H,(H,24,25,26);/q;+1/p-1/b17-12-;