2-[[2-[2-[2-(Bis(Carboxymethyl)Amino)-5-[(E)-2-(3-Ethyl-1,3-Benzothiazol-3-Ium-2-Yl)Ethenyl]Phenoxy]Ethoxy]-4-Methylphenyl]-(Carboxymethyl)Amino]Acetic Acid Iodide
[CAS# 150669-69-5]

Identification

• Name: 2-[[2-[2-[2-(Bis(Carboxymethyl)Amino)-5-[(E)-2-(3-Ethyl-1,3-Benzothiazol-3-Ium-2-Yl)Ethenyl]Phenoxy]Ethoxy]-4-Methylphenyl]-(Carboxymethyl)Amino]Acetic Acid Iodide
• Synonyms: 2-[[2-[2-[2-(Bis(Carboxymethyl)Amino)-5-[(E)-2-(3-Ethyl-1,3-Benzothiazol-3-Ium-2-Yl)Vinyl]Phenoxy]Ethoxy]-4-Methyl-Phenyl]-(Carboxymethyl)Amino]Acetic Acid Iodide; 2-[[2-[2-[2-(Bis(Carboxymethyl)Amino)-5-[(E)-2-(3-Ethyl-1,3-Benzothiazol-3-Ium-2-Yl)Vinyl]Phenoxy]Ethoxy]-4-Methylphenyl]-(Carboxymethyl)Amino]Acetic Acid Iodide; 2-[[2-[2-[2-(Bis(Carboxymethyl)Amino)-5-[(E)-2-(3-Ethyl-1,3-Benzothiazol-3-Ium-2-Yl)Ethenyl]Phenoxy]Ethoxy]-4-Methyl-Phenyl]-(Carboxymethyl)Amino]Ethanoic Acid Iodide
• Molecular Formula: C₃₄H₃₆IN₃O₁₀S
• Molecular Weight: 805.64
• CAS Registry Number: 150669-69-5
• SMILES: C3=C(C=CC2=[N+](C1=CC=CC=C1S2)CC)C=CC(=C3OCCOC4=C(N(CC(O)=O)CC(O)=O)C=CC(=C4)C)N(CC(O)=O)CC(O)=O.[I-]
• InChI: 1S/C34H35N3O10S.HI/c1-3-37-26-6-4-5-7-29(26)48-30(37)13-10-23-9-12-25(36(20-33(42)43)21-34(44)45)28(17-23)47-15-14-46-27-16-22(2)8-11-24(27)35(18-31(38)39)19-32(40)41;/h4-13,16-17H,3,14-15,18-21H2,1-2H3,(H3-,38,39,40,41,42,43,44,45);1H
• InChIKey: AJICOSVECOHRCM-UHFFFAOYSA-N