(6E)-4-azanyl-6-[(3,5-dinitro-2-oxidanyl-phenyl)hydrazinylidene]-5-oxidanylidene-naphthalene-1-sulfonic acid

Systemtic Name: (6E)-4-azanyl-6-[(3,5-dinitro-2-oxidanyl-phenyl)hydrazinylidene]-5-oxidanylidene-naphthalene-1-sulfonic acid Openeye Name: (6E)-4-amino-6-[(2-hydroxy-3,5-dinitro-phenyl)hydrazono]-5-oxo-naphthalene-1-sulfonic acid CAS Name: (6E)-4-amino-6-[(2-hydroxy-3,5-dinitrophenyl)hydrazinylidene]-5-oxo-1-naphthalenesulfonic acid IUPAC Name: (6E)-4-amino-6-[(2-hydroxy-3,5-dinitrophenyl)hydrazinylidene]-5-oxonaphthalene-1-sulfonic acid Traditional Name: (6E)-4-amino-6-[(2-hydroxy-3,5-dinitro-phenyl)hydrazono]-5-keto-naphthalene-1-sulfonic acid Formula: C16H11N5O9S MolecularWeight: 449.35164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NNC2=CC(=CC(=C2O)[N+](=O)[O-])[N+](=O)[O-])C(=O)C3=C(C=CC(=C31)S(=O)(=O)O)N

Isomeric SMILES

C1=C/C(=N\NC2=CC(=CC(=C2O)[N+](=O)[O-])[N+](=O)[O-])/C(=O)C3=C(C=CC(=C31)S(=O)(=O)O)N

InChI

InChI=1S/C16H11N5O9S/c17-9-2-4-13(31(28,29)30)8-1-3-10(16(23)14(8)9)18-19-11-5-7(20(24)25)6-12(15(11)22)21(26)27/h1-6,19,22H,17H2,(H,28,29,30)/b18-10+