[2-[2-[2-(Bis(Carboxymethyl)Amino)-5-Methylphenoxy]Ethoxy]-4-[3,6-Bis(Dimethylamino)Xanthen-9-Ylidene]-1-Cyclohexa-2,5-Dienylidene]-Bis(Carboxymethyl)Azanium Chloride
[CAS# 132523-91-2]

Identification

• Name: [2-[2-[2-(Bis(Carboxymethyl)Amino)-5-Methylphenoxy]Ethoxy]-4-[3,6-Bis(Dimethylamino)Xanthen-9-Ylidene]-1-Cyclohexa-2,5-Dienylidene]-Bis(Carboxymethyl)Azanium Chloride
• Synonyms: [2-[2-[2-(Bis(Carboxymethyl)Amino)-5-Methyl-Phenoxy]Ethoxy]-4-[3,6-Bis(Dimethylamino)Xanthen-9-Ylidene]-1-Cyclohexa-2,5-Dienylidene]-Bis(Carboxymethyl)Ammonium Chloride; [2-[2-[2-(Bis(Carboxymethyl)Amino)-5-Methylphenoxy]Ethoxy]-4-[3,6-Bis(Dimethylamino)-9-Xanthenylidene]-1-Cyclohexa-2,5-Dienylidene]-Bis(Carboxymethyl)Ammonium Chloride; [2-[2-[2-(Bis(Carboxymethyl)Amino)-5-Methyl-Phenoxy]Ethoxy]-4-[3,6-Bis(Dimethylamino)Xanthen-9-Ylidene]-1-Cyclohexa-2,5-Dienylidene]-Bis(Carboxymethyl)Azanium Chloride
• Molecular Formula: C₄₀H₄₃ClN₄O₁₁
• Molecular Weight: 791.25
• CAS Registry Number: 132523-91-2
• SMILES: [O+]1=C5C(=C(C2=C1C=C(N(C)C)C=C2)C3=CC(=C(N(CC(O)=O)CC(O)=O)C=C3)OCCOC4=C(N(CC(O)=O)CC(O)=O)C=CC(=C4)C)C=CC(=C5)N(C)C.[Cl-]
• InChI: 1S/C40H42N4O11.ClH/c1-24-6-12-30(43(20-36(45)46)21-37(47)48)34(16-24)53-14-15-54-35-17-25(7-13-31(35)44(22-38(49)50)23-39(51)52)40-28-10-8-26(41(2)3)18-32(28)55-33-19-27(42(4)5)9-11-29(33)40;/h6-13,16-19H,14-15,20-23H2,1-5H3,(H3-,45,46,47,48,49,50,51,52);1H
• InChIKey: APERIXFHHNDFQV-UHFFFAOYSA-N