Sodium Hydrogen 6-(Acetylmethylamino)-4-Hydroxy-3-[(3-Phosphonatophenyl)Azo]Naphthalene-2-Sulphonate
[CAS# 68133-28-8]

Identification

• Name: Sodium Hydrogen 6-(Acetylmethylamino)-4-Hydroxy-3-[(3-Phosphonatophenyl)Azo]Naphthalene-2-Sulphonate
• Synonyms: Sodium (3E)-6-(Acetonylamino)-4-Oxo-3-[(3-Phosphonophenyl)Hydrazono]Naphthalene-2-Sulfonate; Sodium (3E)-6-(Acetonylamino)-4-Oxo-3-[(3-Phosphonophenyl)Hydrazono]-2-Naphthalenesulfonate; Sodium (3E)-6-(Acetonylamino)-4-Keto-3-[(3-Phosphonophenyl)Hydrazono]Naphthalene-2-Sulfonate
• Molecular Formula: C₁₉H₁₇N₃NaO₈PS
• Molecular Weight: 501.38
• CAS Registry Number: 68133-28-8
• EINECS: 268-671-4
• SMILES: C1=C(NCC(=O)C)C=CC3=C1C(=O)C(=N/NC2=CC(=CC=C2)[P](O)(O)=O)\C(=C3)[S]([O-])(=O)=O.[Na+]
• InChI: 1S/C19H18N3O8PS.Na/c1-11(23)10-20-13-6-5-12-7-17(32(28,29)30)18(19(24)16(12)9-13)22-21-14-3-2-4-15(8-14)31(25,26)27;/h2-9,20-21H,10H2,1H3,(H2,25,26,27)(H,28,29,30);/q;+1/p-1/b22-18-
• InChIKey: KLHUKPWTNYZABF-QNCGTCMPSA-M