Tetrasodium 2,2'-[Carbonylbis[Imino(1-Hydroxy-3-Sulphonato-6,2-Naphthalenediyl)Azo-3,1-Phenyleneimino]]Bis(2-Oxoacetate)
[CAS# 68400-33-9]

Identification

• Name: Tetrasodium 2,2'-[Carbonylbis[Imino(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]Carbamoylamino]-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]-Oxomethyl]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]Carbamoylamino]-3-Sulfonato-2-Naphthylidene]Hydrazino]Phenyl]Amino]Acetate
• Molecular Formula: C₃₇H₂₂N₈Na₄O₁₅S₂
• Molecular Weight: 974.70
• CAS Registry Number: 68400-33-9
• EINECS: 270-022-5
• SMILES: C4=C(NC(=O)NC3=CC2=C(C(=O)C(=N/NC1=CC=CC(=C1)NC(=O)C([O-])=O)/C(=C2)[S]([O-])(=O)=O)C=C3)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/C37H26N8O15S2.4Na/c46-31-25-9-7-21(11-17(25)13-27(61(55,56)57)29(31)44-42-23-5-1-3-19(15-23)38-33(48)35(50)51)40-37(54)41-22-8-10-26-18(12-22)14-28(62(58,59)60)30(32(26)47)45-43-24-6-2-4-20(16-24)39-34(49)36(52)53;;;;/h1-16,42-43H,(H,38,48)(H,39,49)(H,50,51)(H,52,53)(H2,40,41,54)(H,55,56,57)(H,58,59,60);;;;/q;4*+1/p-4/b44-29-,45-30+
• InChIKey: SOOWGLUNGKHCPR-MJBBTXHGSA-J