3-(2-Acetoxyethyl)-2-{3-[3-(2-Acetoxyethyl)-5-Cyano-1-Ethyl-1,3-Dihydro-2H-Benzimidazol-2-Ylidene]-1-Propen-1-Yl}-5-Cyano-1-Ethyl-2,3-Dihydro-1H-3,1-Benzimidazol-1-Ium Bromide
[CAS# 53132-01-7]

Identification

• Name: 3-(2-Acetoxyethyl)-2-{3-[3-(2-Acetoxyethyl)-5-Cyano-1-Ethyl-1,3-Dihydro-2H-Benzimidazol-2-Ylidene]-1-Propen-1-Yl}-5-Cyano-1-Ethyl-2,3-Dihydro-1H-3,1-Benzimidazol-1-Ium Bromide
• Synonyms: 3-[2-(acetoxy)ethyl]-2-[3-[3-[2-(acetoxy)ethyl]-5-cyano-1-ethyl-1,3-dihydro-2H-benzimidazol-2-ylidene]-1-propenyl]-5-cyano-1-ethyl-1H-benzimidazolium bromide
• Molecular Formula: C₃₁H₃₅BrN₆O₄
• Molecular Weight: 635.55
• CAS Registry Number: 53132-01-7
• EINECS: 258-385-8
• SMILES: [Br-].CC(=O)OCCN3c4cc(C#N)ccc4[NH+](CC)C3C=CC=C2N(CC)c1ccc(cc1N2CCOC(C)=O)C#N
• InChI: 1S/C31H34N6O4.BrH/c1-5-34-26-12-10-24(20-32)18-28(26)36(14-16-40-22(3)38)30(34)8-7-9-31-35(6-2)27-13-11-25(21-33)19-29(27)37(31)15-17-41-23(4)39;/h7-13,18-19,30H,5-6,14-17H2,1-4H3;1H
• InChIKey: DRVDEOONJSBAPO-UHFFFAOYSA-N