sodium (6Z)-6-[(5-chloranyl-2-oxidanyl-4-sulfo-phenyl)hydrazinylidene]-5-oxidanylidene-naphthalene-1-sulfonate

Systemtic Name: sodium (6Z)-6-[(5-chloranyl-2-oxidanyl-4-sulfo-phenyl)hydrazinylidene]-5-oxidanylidene-naphthalene-1-sulfonate Openeye Name: sodium (6Z)-6-[(5-chloro-2-hydroxy-4-sulfo-phenyl)hydrazono]-5-oxo-naphthalene-1-sulfonate CAS Name: sodium (6Z)-6-[(5-chloro-2-hydroxy-4-sulfophenyl)hydrazinylidene]-5-oxo-1-naphthalenesulfonate IUPAC Name: sodium (6Z)-6-[(5-chloro-2-hydroxy-4-sulfophenyl)hydrazinylidene]-5-oxonaphthalene-1-sulfonate Traditional Name: sodium (6Z)-6-[(5-chloro-2-hydroxy-4-sulfo-phenyl)hydrazono]-5-keto-naphthalene-1-sulfonate Formula: C16H10ClN2NaO8S2 MolecularWeight: 480.83197

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11ClN2O8S2.Na/c17-10-6-12(13(20)7-15(10)29(25,26)27)19-18-11-5-4-8-9(16(11)21)2-1-3-14(8)28(22,23)24;/h1-7,19-20H,(H,22,23,24)(H,25,26,27);/q;+1/p-1/b18-11-;