4-[(3-nitrophenyl)hydrazinylidene]-3-oxidanylidene-naphthalene-2,7-disulfonic acid; sodium

Systemtic Name: 4-[(3-nitrophenyl)hydrazinylidene]-3-oxidanylidene-naphthalene-2,7-disulfonic acid; sodium Openeye Name: 4-[(3-nitrophenyl)hydrazono]-3-oxo-naphthalene-2,7-disulfonic acid; sodium CAS Name: 4-[(3-nitrophenyl)hydrazinylidene]-3-oxonaphthalene-2,7-disulfonic acid; sodium IUPAC Name: 4-[(3-nitrophenyl)hydrazinylidene]-3-oxonaphthalene-2,7-disulfonic acid; sodium Traditional Name: 3-keto-4-[(3-nitrophenyl)hydrazono]naphthalene-2,7-disulfonic acid; sodium Formula: C16H11N3NaO9S2 MolecularWeight: 476.39301

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NN=C2C3=C(C=C(C=C3)S(=O)(=O)O)C=C(C2=O)S(=O)(=O)O.[Na]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NN=C2C3=C(C=C(C=C3)S(=O)(=O)O)C=C(C2=O)S(=O)(=O)O.[Na]

InChI

InChI=1S/C16H11N3O9S2.Na/c20-16-14(30(26,27)28)7-9-6-12(29(23,24)25)4-5-13(9)15(16)18-17-10-2-1-3-11(8-10)19(21)22;/h1-8,17H,(H,23,24,25)(H,26,27,28);