Sodium Hydrogen 5-[(2-{4-[4-(Dimethylamino)Benzylidene]-3-Methyl-5-Oxo-4,5-Dihydro-1H-Pyrazol-1-Yl}-4-Sulfonatophenyl)Sulfonyl]-2-Hydroxybenzoate (1:1:1)
[CAS# 24221-19-0]

Identification

• Name: Sodium Hydrogen 5-[(2-{4-[4-(Dimethylamino)Benzylidene]-3-Methyl-5-Oxo-4,5-Dihydro-1H-Pyrazol-1-Yl}-4-Sulfonatophenyl)Sulfonyl]-2-Hydroxybenzoate (1:1:1)
• Synonyms: sodium hydrogen 5-[[2-[4-[[4-(dimethylamino)phenyl]methylene]-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl]-4-sulphonatophenyl]sulphonyl]salicylate
• Molecular Formula: C₂₆H₂₂N₃NaO₉S₂
• Molecular Weight: 607.59
• CAS Registry Number: 24221-19-0
• EINECS: 246-089-1
• SMILES: [H+].[Na+].[O-]C(=O)c1cc(ccc1O)S(=O)(=O)c2ccc(cc2N4/N=C(/C)C(=Cc3ccc(cc3)N(C)C)C4=O)S([O-])(=O)=O
• InChI: 1S/C26H23N3O9S2.Na/c1-15-20(12-16-4-6-17(7-5-16)28(2)3)25(31)29(27-15)22-14-19(40(36,37)38)9-11-24(22)39(34,35)18-8-10-23(30)21(13-18)26(32)33;/h4-14,30H,1-3H3,(H,32,33)(H,36,37,38);/q;+1/p-1
• InChIKey: JGYGXICGUODKQB-UHFFFAOYSA-M

Properties

• Refractive index: (Cal.)