Tetrasodium P,P'-[Vinylenebis[(3-Sulphonato-p-Phenylene)-Onn-Azoxy-p-Phenyleneazo]]Dibenzoate
[CAS# 71873-49-9]

Identification

• Name: Tetrasodium P,P'-[Vinylenebis[(3-Sulphonato-p-Phenylene)-Onn-Azoxy-p-Phenyleneazo]]Dibenzoate
• Synonyms: Tetrasodium 4-[4-[[[4-[(E)-2-[4-[[4-(4-Carboxylatophenyl)Azophenyl]Imino-Oxido-Azaniumyl]-2-Sulfonato-Phenyl]Vinyl]-3-Sulfonato-Phenyl]-Oxido-Azaniumylidene]Amino]Phenyl]Azobenzoate; Tetrasodium 4-[4-[[[4-[(E)-2-[4-[[4-(4-Carboxylatophenyl)Azophenyl]Imino-Oxidoazaniumyl]-2-Sulfonatophenyl]Vinyl]-3-Sulfonatophenyl]-Oxidoazaniumylidene]Amino]Phenyl]Azobenzoate; Tetrasodium 4-[4-[[[4-[(E)-2-[4-[[4-(4-Carboxylatophenyl)Diazenylphenyl]Imino-Oxido-Azaniumyl]-2-Sulfonato-Phenyl]Ethenyl]-3-Sulfonato-Phenyl]-Oxido-Azaniumylidene]Amino]Phenyl]Diazenylbenzoate
• Molecular Formula: C₄₀H₂₄N₈Na₄O₁₂S₂
• Molecular Weight: 964.76
• CAS Registry Number: 71873-49-9
• EINECS: 276-125-1
• SMILES: C1=C([S]([O-])(=O)=O)C(=CC=C1[N+](=O)[N-]C3=CC=C(N=NC2=CC=C(C=C2)C([O-])=O)C=C3)\C=C\C6=CC=C([N+](=O)[N-]C5=CC=C(N=NC4=CC=C(C=C4)C([O-])=O)C=C5)C=C6[S]([O-])(=O)=O.[Na+].[Na+].[Na+].[Na+]
• InChI: 1S/C40H28N8O12S2.4Na/c49-39(50)27-3-9-29(10-4-27)41-43-31-13-17-33(18-14-31)45-47(53)35-21-7-25(37(23-35)61(55,56)57)1-2-26-8-22-36(24-38(26)62(58,59)60)48(54)46-34-19-15-32(16-20-34)44-42-30-11-5-28(6-12-30)40(51)52;;;;/h1-24H,(H,49,50)(H,51,52)(H,55,56,57)(H,58,59,60);;;;/q;4*+1/p-4/b2-1+,43-41?,44-42?,47-45?,48-46?
• InChIKey: ZHMNNCYAYMTORS-GWJQYIOFSA-J