disodium (6Z)-4-azanyl-6-[(4-nitro-2-sulfonato-phenyl)hydrazinylidene]-5-oxidanylidene-naphthalene-2-sulfonate

Systemtic Name: disodium (6Z)-4-azanyl-6-[(4-nitro-2-sulfonato-phenyl)hydrazinylidene]-5-oxidanylidene-naphthalene-2-sulfonate Openeye Name: disodium (6Z)-4-amino-6-[(4-nitro-2-sulfonato-phenyl)hydrazono]-5-oxo-naphthalene-2-sulfonate CAS Name: disodium (6Z)-4-amino-6-[(4-nitro-2-sulfonatophenyl)hydrazinylidene]-5-oxo-2-naphthalenesulfonate IUPAC Name: disodium (6Z)-4-amino-6-[(4-nitro-2-sulfonatophenyl)hydrazinylidene]-5-oxonaphthalene-2-sulfonate Traditional Name: disodium (6Z)-4-amino-5-keto-6-[(4-nitro-2-sulfonato-phenyl)hydrazono]naphthalene-2-sulfonate Formula: C16H10N4Na2O9S2 MolecularWeight: 512.38154

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NNC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)[O-])C(=O)C3=C(C=C(C=C31)S(=O)(=O)[O-])N.[Na+].[Na+]

Isomeric SMILES

C1=C/C(=N/NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)[O-])/C(=O)C3=C(C=C(C=C31)S(=O)(=O)[O-])N.[Na+].[Na+]

InChI

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