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

Systemtic Name: (6E)-6-[(3,5-dinitro-2-oxidanyl-phenyl)hydrazinylidene]-5-oxidanylidene-naphthalene-1-sulfonic acid Openeye Name: (6E)-6-[(2-hydroxy-3,5-dinitro-phenyl)hydrazono]-5-oxo-naphthalene-1-sulfonic acid CAS Name: (6E)-6-[(2-hydroxy-3,5-dinitrophenyl)hydrazinylidene]-5-oxo-1-naphthalenesulfonic acid IUPAC Name: (6E)-6-[(2-hydroxy-3,5-dinitrophenyl)hydrazinylidene]-5-oxonaphthalene-1-sulfonic acid Traditional Name: (6E)-6-[(2-hydroxy-3,5-dinitro-phenyl)hydrazono]-5-keto-naphthalene-1-sulfonic acid Formula: C16H10N4O9S MolecularWeight: 434.337

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H10N4O9S/c21-15-10-2-1-3-14(30(27,28)29)9(10)4-5-11(15)17-18-12-6-8(19(23)24)7-13(16(12)22)20(25)26/h1-7,18,22H,(H,27,28,29)/b17-11+