disodium (3E)-3-[(2-aminophenyl)hydrazinylidene]-5-oxidanyl-4-oxidanylidene-naphthalene-2,7-disulfonate

Systemtic Name: disodium (3E)-3-[(2-aminophenyl)hydrazinylidene]-5-oxidanyl-4-oxidanylidene-naphthalene-2,7-disulfonate Openeye Name: disodium (3E)-3-[(2-aminophenyl)hydrazono]-5-hydroxy-4-oxo-naphthalene-2,7-disulfonate CAS Name: disodium (3E)-3-[(2-aminophenyl)hydrazinylidene]-5-hydroxy-4-oxonaphthalene-2,7-disulfonate IUPAC Name: disodium (3E)-3-[(2-aminophenyl)hydrazinylidene]-5-hydroxy-4-oxonaphthalene-2,7-disulfonate Traditional Name: disodium (3E)-3-[(2-aminophenyl)hydrazono]-5-hydroxy-4-keto-naphthalene-2,7-disulfonate Formula: C16H11N3Na2O8S2 MolecularWeight: 483.38338

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N)NN=C2C(=CC3=CC(=CC(=C3C2=O)O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

C1=CC=C(C(=C1)N)N/N=C\2/C(=CC3=CC(=CC(=C3C2=O)O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C16H13N3O8S2.2Na/c17-10-3-1-2-4-11(10)18-19-15-13(29(25,26)27)6-8-5-9(28(22,23)24)7-12(20)14(8)16(15)21;;/h1-7,18,20H,17H2,(H,22,23,24)(H,25,26,27);;/q;2*+1/p-2/b19-15-;;