Barium 2-{[3-methyl-5-oxo-1-(4-sulfonatophenyl)-4,5-dihydro-1H-pyrazol-4-yl]diazenyl}benzoate
[CAS# 82469-76-9]

Identification

• Name: Barium 2-{[3-methyl-5-oxo-1-(4-sulfonatophenyl)-4,5-dihydro-1H-pyrazol-4-yl]diazenyl}benzoate
• Synonyms: barium 2-[[4,5-dihydro-3-methyl-5-oxo-1-(4-sulphonatophenyl)-1H-pyrazol-4-yl]azo]benzoate
• Molecular Formula: C₁₇H₁₂BaN₄O₆S
• Molecular Weight: 537.69
• CAS Registry Number: 82469-76-9
• EINECS: 279-972-5
• SMILES: [Ba+2].[O-]C(=O)c3ccccc3N=NC2C(\C)=N/N(c1ccc(cc1)S([O-])(=O)=O)C2=O
• InChI: 1S/C17H14N4O6S.Ba/c1-10-15(19-18-14-5-3-2-4-13(14)17(23)24)16(22)21(20-10)11-6-8-12(9-7-11)28(25,26)27;/h2-9,15H,1H3,(H,23,24)(H,25,26,27);/q;+2/p-2
• InChIKey: UYBVUDJBJKBSBV-UHFFFAOYSA-L