5-[[4'-[[6-Amino-5-(1H-Benzotriazol-5-Ylazo)-1-Hydroxy-3-Sulfo-2-Naphthalenyl ]Azo]-3,3'-Dimethoxy[1,1'-Biphenyl]-4-Yl]Azo]-2-Hydroxy-4-Methyl-Benzoic Acid Disodium Salt
[CAS# 70210-28-5]

Identification

• Name: 5-[[4'-[[6-Amino-5-(1H-Benzotriazol-5-Ylazo)-1-Hydroxy-3-Sulfo-2-Naphthalenyl ]Azo]-3,3'-Dimethoxy[1,1'-Biphenyl]-4-Yl]Azo]-2-Hydroxy-4-Methyl-Benzoic Acid Disodium Salt
• Synonyms: Disodium (3E)-3-[[4-[4-[(N'e)-N'-[6-Amino-5-(2H-Benzotriazol-5-Ylazo)-1-Oxo-3-Sulfonato-2-Naphthylidene]Hydrazino]-3-Methoxy-Phenyl]-2-Methoxy-Phenyl]Hydrazono]-4-Methyl-6-Oxo-Cyclohexa-1,4-Diene-1-Carboxylate; Disodium (3E)-3-[[4-[4-[(N'e)-N'-[6-Amino-5-(2H-Benzotriazol-5-Ylazo)-1-Oxo-3-Sulfonato-2-Naphthylidene]Hydrazino]-3-Methoxyphenyl]-2-Methoxyphenyl]Hydrazono]-4-Methyl-6-Oxo-1-Cyclohexa-1,4-Dienecarboxylate; Disodium (3E)-3-[[4-[4-[(N'e)-N'-[6-Amino-5-(2H-Benzotriazol-5-Ylazo)-1-Keto-3-Sulfonato-2-Naphthylidene]Hydrazino]-3-Methoxy-Phenyl]-2-Methoxy-Phenyl]Hydrazono]-6-Keto-4-Methyl-Cyclohexa-1,4-Diene-1-Carboxylate
• Molecular Formula: C₃₈H₂₈N₁₀Na₂O₉S
• Molecular Weight: 846.74
• CAS Registry Number: 70210-28-5
• SMILES: C3=CC(=C(N=NC2=CC1=N[NH]N=C1C=C2)C7=C3C(=O)C(=N/NC6=C(OC)C=C(C5=CC(=C(N\N=C4\C(=CC(=O)C(=C4)C([O-])=O)C)C=C5)OC)C=C6)\C(=C7)[S]([O-])(=O)=O)N.[Na+].[Na+]
• InChI: 1S/C38H30N10O9S.2Na/c1-18-12-31(49)24(38(51)52)16-29(18)43-41-27-9-4-19(13-32(27)56-2)20-5-10-28(33(14-20)57-3)42-47-36-34(58(53,54)55)17-23-22(37(36)50)7-8-25(39)35(23)46-40-21-6-11-26-30(15-21)45-48-44-26;;/h4-17,41-42H,39H2,1-3H3,(H,51,52)(H,44,45,48)(H,53,54,55);;/q;2*+1/p-2/b43-29+,46-40?,47-36-
• InChIKey: YKBQGCJUHPGDFK-YVFFLNNYSA-L