Sodium 3-[(4,5-Dihydro-3-Methyl-5-Oxo-1-Phenyl-1H-Pyrazol-4-Yl)Azo]-2-Hydroxy-5-Nitrobenzenesulphonate
[CAS# 6054-86-0]

Identification

• Name: Sodium 3-[(4,5-Dihydro-3-Methyl-5-Oxo-1-Phenyl-1H-Pyrazol-4-Yl)Azo]-2-Hydroxy-5-Nitrobenzenesulphonate
• Synonyms: Sodium (5E)-5-[(3-Methyl-5-Oxo-1-Phenyl-4H-Pyrazol-4-Yl)Hydrazono]-3-Nitro-6-Oxo-Cyclohexa-1,3-Diene-1-Sulfonate; Sodium (5E)-5-[(3-Methyl-5-Oxo-1-Phenyl-4H-Pyrazol-4-Yl)Hydrazono]-3-Nitro-6-Oxo-1-Cyclohexa-1,3-Dienesulfonate; Sodium (5E)-6-Keto-5-[(5-Keto-3-Methyl-1-Phenyl-4H-Pyrazol-4-Yl)Hydrazono]-3-Nitro-Cyclohexa-1,3-Diene-1-Sulfonate
• Molecular Formula: C₁₆H₁₂N₅NaO₇S
• Molecular Weight: 441.35
• CAS Registry Number: 6054-86-0
• EINECS: 227-973-6
• SMILES: C3=C(N2N=C(C(N\N=C1\C(=O)C(=CC(=C1)[N+]([O-])=O)[S]([O-])(=O)=O)C2=O)C)C=CC=C3.[Na+]
• InChI: 1S/C16H13N5O7S.Na/c1-9-14(16(23)20(19-9)10-5-3-2-4-6-10)18-17-12-7-11(21(24)25)8-13(15(12)22)29(26,27)28;/h2-8,14,18H,1H3,(H,26,27,28);/q;+1/p-1/b17-12+
• InChIKey: UYHHVTZOUWMHDP-KCUXUEJTSA-M