Tetrasodium 2,2'-[Iminobis[(1-Hydroxy-3-Sulphonato-6,2-Naphthalenediyl)Azo-3,1-Phenyleneimino]]Bis(2-Oxoacetate)
[CAS# 68631-10-7]

Identification

• Name: Tetrasodium 2,2'-[Iminobis[(1-Hydroxy-3-Sulphonato-6,2-Naphthalenediyl)Azo-3,1-Phenyleneimino]]Bis(2-Oxoacetate)
• Synonyms: Tetrasodium 2-[[3-[(N'z)-N'-[6-[[(6E)-6-[[3-[(2-Oxido-2-Oxo-Acetyl)Amino]Phenyl]Hydrazono]-5-Oxo-7-Sulfonato-2-Naphthyl]Amino]-1-Oxo-3-Sulfonato-2-Naphthylidene]Hydrazino]Phenyl]Amino]-2-Oxo-Acetate; Tetrasodium 2-[[3-[(N'z)-N'-[6-[[(6E)-6-[[3-[(2-Oxido-1,2-Dioxoethyl)Amino]Phenyl]Hydrazono]-5-Oxo-7-Sulfonato-2-Naphthyl]Amino]-1-Oxo-3-Sulfonato-2-Naphthylidene]Hydrazino]Phenyl]Amino]-2-Oxoacetate; Tetrasodium 2-Keto-2-[[3-[(N'z)-N'-[1-Keto-6-[[(6E)-5-Keto-6-[[3-[(2-Keto-2-Oxido-Acetyl)Amino]Phenyl]Hydrazono]-7-Sulfonato-2-Naphthyl]Amino]-3-Sulfonato-2-Naphthylidene]Hydrazino]Phenyl]Amino]Acetate
• Molecular Formula: C₃₆H₂₁N₇Na₄O₁₄S₂
• Molecular Weight: 931.68
• CAS Registry Number: 68631-10-7
• EINECS: 271-935-1
• SMILES: C4=C(NC1=CC3=C(C=C1)C(=O)C(=N/NC2=CC=CC(=C2)NC(=O)C([O-])=O)/C(=C3)[S]([O-])(=O)=O)C=CC6=C4C=C([S]([O-])(=O)=O)/C(=N/NC5=CC=CC(=C5)NC(=O)C([O-])=O)C6=O.[Na+].[Na+].[Na+].[Na+]
• InChI: 1S/C36H25N7O14S2.4Na/c44-31-25-9-7-21(11-17(25)13-27(58(52,53)54)29(31)42-40-23-5-1-3-19(15-23)38-33(46)35(48)49)37-22-8-10-26-18(12-22)14-28(59(55,56)57)30(32(26)45)43-41-24-6-2-4-20(16-24)39-34(47)36(50)51;;;;/h1-16,37,40-41H,(H,38,46)(H,39,47)(H,48,49)(H,50,51)(H,52,53,54)(H,55,56,57);;;;/q;4*+1/p-4/b42-29-,43-30+
• InChIKey: IZIRNAWMZGPLMH-QHJPAERHSA-J