4-[[5-[[5-(Aminosulfonyl)-2-Hydroxyphenyl]Azo]-1-Hydroxy-6-(Phenylamino)-3-Sulfo-2-Naphthalenyl]Azo]-4'-[[1-[[(3-Carboxy-4-Hydroxyphenyl)Amino]Carbonyl]-2-Oxopropyl]Azo]-[1,1'-Biphenyl]-3,3'-Dicarboxylic Acid Tetrasodium Salt
[CAS# 72252-59-6]

Identification

• Name: 4-[[5-[[5-(Aminosulfonyl)-2-Hydroxyphenyl]Azo]-1-Hydroxy-6-(Phenylamino)-3-Sulfo-2-Naphthalenyl]Azo]-4'-[[1-[[(3-Carboxy-4-Hydroxyphenyl)Amino]Carbonyl]-2-Oxopropyl]Azo]-[1,1'-Biphenyl]-3,3'-Dicarboxylic Acid Tetrasodium Salt
• Molecular Formula: C₄₇H₃₁N₉Na₄O₁₆S₂
• Molecular Weight: 1133.89
• CAS Registry Number: 72252-59-6
• EINECS: 276-539-2
• SMILES: C45=CC(=C(N=NC1=CC=C(C=C1C(=O)[O-])C2=CC=C(C(=C2)C(=O)[O-])N=NC(C(C)=O)C(=O)NC3=CC=C(C(=C3)C(=O)[O-])O)C(=C4C=CC(=C5N=NC6=CC(=CC=C6O)[S](=O)(=O)N)NC7=CC=CC=C7)O)[S](=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]
• InChI: 1S/C47H35N9O16S2.4Na/c1-22(57)40(44(61)50-26-9-15-37(58)32(19-26)47(66)67)54-51-33-12-7-23(17-30(33)45(62)63)24-8-13-34(31(18-24)46(64)65)52-56-42-39(74(70,71)72)21-29-28(43(42)60)11-14-35(49-25-5-3-2-4-6-25)41(29)55-53-36-20-27(73(48,68)69)10-16-38(36)59;;;;/h2-21,40,49,58-60H,1H3,(H,50,61)(H,62,63)(H,64,65)(H,66,67)(H2,48,68,69)(H,70,71,72);;;;/q;4*+1/p-4
• InChIKey: CKKWAQWRRWDFDW-UHFFFAOYSA-J