(8E)-8-[(2-methylsulfonyl-4-nitro-phenyl)hydrazinylidene]-5-oxidanylidene-naphthalene-2-sulfonic acid

Systemtic Name: (8E)-8-[(2-methylsulfonyl-4-nitro-phenyl)hydrazinylidene]-5-oxidanylidene-naphthalene-2-sulfonic acid Openeye Name: (8E)-8-[(2-methylsulfonyl-4-nitro-phenyl)hydrazono]-5-oxo-naphthalene-2-sulfonic acid CAS Name: (8E)-8-[(2-methylsulfonyl-4-nitrophenyl)hydrazinylidene]-5-oxo-2-naphthalenesulfonic acid IUPAC Name: (8E)-8-[(2-methylsulfonyl-4-nitrophenyl)hydrazinylidene]-5-oxonaphthalene-2-sulfonic acid Traditional Name: (8E)-5-keto-8-[(2-mesyl-4-nitro-phenyl)hydrazono]naphthalene-2-sulfonic acid Formula: C17H13N3O8S2 MolecularWeight: 451.43042

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NN=C2C=CC(=O)C3=C2C=C(C=C3)S(=O)(=O)O

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])N/N=C/2\C=CC(=O)C3=C2C=C(C=C3)S(=O)(=O)O

InChI

InChI=1S/C17H13N3O8S2/c1-29(24,25)17-8-10(20(22)23)2-5-15(17)19-18-14-6-7-16(21)12-4-3-11(9-13(12)14)30(26,27)28/h2-9,19H,1H3,(H,26,27,28)/b18-14+