Sodium 3-(4,5-Dichloro-O-Tolyl)-1-(1,3-Dihydro-1-Oxo-5-Isobenzofuranyl)-4,5-Dihydro-1H-Pyrazole-4-Methanesulphonate
[CAS# 58953-08-5]

Identification

• Name: Sodium 3-(4,5-Dichloro-O-Tolyl)-1-(1,3-Dihydro-1-Oxo-5-Isobenzofuranyl)-4,5-Dihydro-1H-Pyrazole-4-Methanesulphonate
• Synonyms: Sodium [3-(4,5-Dichloro-2-Methyl-Phenyl)-1-(1-Oxo-3H-Isobenzofuran-5-Yl)-4,5-Dihydropyrazol-4-Yl]Methanesulfonate; Sodium [3-(4,5-Dichloro-2-Methylphenyl)-1-(1-Oxo-3H-Isobenzofuran-5-Yl)-4,5-Dihydropyrazol-4-Yl]Methanesulfonate; Sodium [3-(4,5-Dichloro-2-Methyl-Phenyl)-1-(1-Keto-3H-Isobenzofuran-5-Yl)-4,5-Dihydropyrazol-4-Yl]Methanesulfonate
• Molecular Formula: C₁₉H₁₅Cl₂N₂NaO₅S
• Molecular Weight: 477.29
• CAS Registry Number: 58953-08-5
• EINECS: 261-519-8
• SMILES: C3=C(N1N=C(C(C1)C[S]([O-])(=O)=O)C2=CC(=C(Cl)C=C2C)Cl)C=CC4=C3COC4=O.[Na+]
• InChI: 1S/C19H16Cl2N2O5S.Na/c1-10-4-16(20)17(21)6-15(10)18-12(9-29(25,26)27)7-23(22-18)13-2-3-14-11(5-13)8-28-19(14)24;/h2-6,12H,7-9H2,1H3,(H,25,26,27);/q;+1/p-1
• InChIKey: WTELQDTYDULSAP-UHFFFAOYSA-M