9-(2-Carboxyphenyl)-3,6-Bis(Diethylamino)Xanthylium Acetate
[CAS# 64381-99-3]

Identification

• Name: 9-(2-Carboxyphenyl)-3,6-Bis(Diethylamino)Xanthylium Acetate
• Synonyms: [9-(2-Carboxyphenyl)-6-Diethylamino-Xanthen-3-Ylidene]-Diethyl-Ammonium Acetate; [9-(2-Carboxyphenyl)-6-Diethylamino-3-Xanthenylidene]-Diethylammonium Acetate; [9-(2-Carboxyphenyl)-6-Diethylamino-Xanthen-3-Ylidene]-Diethyl-Azanium Ethanoate
• Molecular Formula: C₃₀H₃₄N₂O₅
• Molecular Weight: 502.61
• CAS Registry Number: 64381-99-3
• EINECS: 264-859-5
• SMILES: [O+]1=C4C(=C(C2=C1C=C(N(CC)CC)C=C2)C3=C(C(=O)O)C=CC=C3)C=CC(=C4)N(CC)CC.CC([O-])=O
• InChI: 1S/C28H30N2O3.C2H4O2/c1-5-29(6-2)19-13-15-23-25(17-19)33-26-18-20(30(7-3)8-4)14-16-24(26)27(23)21-11-9-10-12-22(21)28(31)32;1-2(3)4/h9-18H,5-8H2,1-4H3;1H3,(H,3,4)
• InChIKey: RWYDZCISLBOUMH-UHFFFAOYSA-N