Sodium 2-[[2-Amino-6-[[4-[[4-[(3-Carboxy-4-Hydroxyphenyl)Azo]-7-Sulpho-1-Naphthyl]Azo]-2,5-Dimethoxyphenyl]Azo]-5-Hydroxy-7-Sulpho-1-Naphthyl]Azo]-5-Nitrobenzoate
[CAS# 84963-16-6]

Identification

• Name: Sodium 2-[[2-Amino-6-[[4-[[4-[(3-Carboxy-4-Hydroxyphenyl)Azo]-7-Sulpho-1-Naphthyl]Azo]-2,5-Dimethoxyphenyl]Azo]-5-Hydroxy-7-Sulpho-1-Naphthyl]Azo]-5-Nitrobenzoate
• Synonyms: Sodium 2-((2-Amino-6-((4-((4-((3-Carboxy-4-Hydroxyphenyl)Azo)-7-Sulpho-1-Naphthyl)Azo)-2,5-Dimethoxyphenyl)Azo)-5-Hydroxy-7-Sulpho-1-Naphthyl)Azo)-5-Nitrobenzoate
• Molecular Formula: C₄₂H₂₉N₁₀NaO₁₆S₂
• Molecular Weight: 1016.86
• CAS Registry Number: 84963-16-6
• EINECS: 284-816-4
• SMILES: C1=C(OC)C(=CC(=C1N=NC4=C(O)C2=C(C(=C(N)C=C2)N=NC3=C(C(=O)[O-])C=C([N+]([O-])=O)C=C3)C=C4[S](=O)(=O)O)OC)N=NC6=CC=C(N=NC5=CC(=C(O)C=C5)C(=O)O)C7=C6C=C([S](=O)(=O)O)C=C7.[Na+]
• InChI: 1S/C42H30N10O16S2.Na/c1-67-35-18-33(49-51-39-37(70(64,65)66)16-25-23(40(39)54)7-8-28(43)38(25)50-47-31-9-4-20(52(59)60)14-26(31)41(55)56)36(68-2)17-32(35)48-46-30-11-10-29(22-6-5-21(15-24(22)30)69(61,62)63)45-44-19-3-12-34(53)27(13-19)42(57)58;/h3-18,53-54H,43H2,1-2H3,(H,55,56)(H,57,58)(H,61,62,63)(H,64,65,66);/q;+1/p-1
• InChIKey: IEQCYSWMPQNZHR-UHFFFAOYSA-M