(3E)-6-azanyl-3-[(5-nitro-2-oxidanyl-3-sulfo-phenyl)hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonic acid

Systemtic Name: (3E)-6-azanyl-3-[(5-nitro-2-oxidanyl-3-sulfo-phenyl)hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonic acid Openeye Name: (3E)-6-amino-3-[(2-hydroxy-5-nitro-3-sulfo-phenyl)hydrazono]-4-oxo-naphthalene-2-sulfonic acid CAS Name: (3E)-6-amino-3-[(2-hydroxy-5-nitro-3-sulfophenyl)hydrazinylidene]-4-oxo-2-naphthalenesulfonic acid IUPAC Name: (3E)-6-amino-3-[(2-hydroxy-5-nitro-3-sulfophenyl)hydrazinylidene]-4-oxonaphthalene-2-sulfonic acid Traditional Name: (3E)-6-amino-3-[(2-hydroxy-5-nitro-3-sulfo-phenyl)hydrazono]-4-keto-naphthalene-2-sulfonic acid Formula: C16H12N4O10S2 MolecularWeight: 484.41728

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1N)C(=O)C(=NNC3=CC(=CC(=C3O)S(=O)(=O)O)[N+](=O)[O-])C(=C2)S(=O)(=O)O

Isomeric SMILES

C1=CC2=C(C=C1N)C(=O)/C(=N\NC3=CC(=CC(=C3O)S(=O)(=O)O)[N+](=O)[O-])/C(=C2)S(=O)(=O)O

InChI

InChI=1S/C16H12N4O10S2/c17-8-2-1-7-3-12(31(25,26)27)14(15(21)10(7)4-8)19-18-11-5-9(20(23)24)6-13(16(11)22)32(28,29)30/h1-6,18,22H,17H2,(H,25,26,27)(H,28,29,30)/b19-14-