sodium (6E)-6-[(2,4-dinitro-6-oxidanyl-phenyl)hydrazinylidene]-5-oxidanylidene-naphthalene-1-sulfonate

Systemtic Name: sodium (6E)-6-[(2,4-dinitro-6-oxidanyl-phenyl)hydrazinylidene]-5-oxidanylidene-naphthalene-1-sulfonate Openeye Name: sodium (6E)-6-[(2-hydroxy-4,6-dinitro-phenyl)hydrazono]-5-oxo-naphthalene-1-sulfonate CAS Name: sodium (6E)-6-[(2-hydroxy-4,6-dinitrophenyl)hydrazinylidene]-5-oxo-1-naphthalenesulfonate IUPAC Name: sodium (6E)-6-[(2-hydroxy-4,6-dinitrophenyl)hydrazinylidene]-5-oxonaphthalene-1-sulfonate Traditional Name: sodium (6E)-6-[(2-hydroxy-4,6-dinitro-phenyl)hydrazono]-5-keto-naphthalene-1-sulfonate Formula: C16H9N4NaO9S MolecularWeight: 456.31883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H10N4O9S.Na/c21-13-7-8(19(23)24)6-12(20(25)26)15(13)18-17-11-5-4-9-10(16(11)22)2-1-3-14(9)30(27,28)29;/h1-7,18,21H,(H,27,28,29);/q;+1/p-1/b17-11+;