(3E)-6-azanyl-3-[(4-nitro-2-sulfo-phenyl)hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonic acid

Systemtic Name: (3E)-6-azanyl-3-[(4-nitro-2-sulfo-phenyl)hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonic acid Openeye Name: (3E)-6-amino-3-[(4-nitro-2-sulfo-phenyl)hydrazono]-4-oxo-naphthalene-2-sulfonic acid CAS Name: (3E)-6-amino-3-[(4-nitro-2-sulfophenyl)hydrazinylidene]-4-oxo-2-naphthalenesulfonic acid IUPAC Name: (3E)-6-amino-3-[(4-nitro-2-sulfophenyl)hydrazinylidene]-4-oxonaphthalene-2-sulfonic acid Traditional Name: (3E)-6-amino-4-keto-3-[(4-nitro-2-sulfo-phenyl)hydrazono]naphthalene-2-sulfonic acid Formula: C16H12N4O9S2 MolecularWeight: 468.41788

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1N)C(=O)C(=NNC3=C(C=C(C=C3)[N+](=O)[O-])S(=O)(=O)O)C(=C2)S(=O)(=O)O

Isomeric SMILES

C1=CC2=C(C=C1N)C(=O)/C(=N\NC3=C(C=C(C=C3)[N+](=O)[O-])S(=O)(=O)O)/C(=C2)S(=O)(=O)O

InChI

InChI=1S/C16H12N4O9S2/c17-9-2-1-8-5-14(31(27,28)29)15(16(21)11(8)6-9)19-18-12-4-3-10(20(22)23)7-13(12)30(24,25)26/h1-7,18H,17H2,(H,24,25,26)(H,27,28,29)/b19-15-