1-[2-[(2-Cyanoethyl)(1-Oxodocosyl)Amino]Ethyl]-2-Henicosyl-4,5-Dihydro-1-Methyl-1H-Imidazolium Methyl Sulphate
[CAS# 67874-08-2]

Identification

• Name: 1-[2-[(2-Cyanoethyl)(1-Oxodocosyl)Amino]Ethyl]-2-Henicosyl-4,5-Dihydro-1-Methyl-1H-Imidazolium Methyl Sulphate
• Synonyms: N-(2-Cyanoethyl)-N-[2-(2-Henicosyl-1-Methyl-4,5-Dihydroimidazole-1,3-Diium-1-Yl)Ethyl]Behenamide; Methyl Sulfate; 1-(2-((2-Cyanoethyl)(1-Oxodocosyl)Amino)Ethyl)-2-Henicosyl-4,5-Dihydro-1-Methyl-1H-Imidazolium Methyl Sulphate; 1H-Imidazolium, 1-(2-((2-Cyanoethyl)(1-Oxodocosyl)Amino)Ethyl)-2-Heneicosyl-4,5-Dihydro-1-Methyl-, Methyl Sulfate
• Molecular Formula: C₅₃H₁₀₅N₄O₅S
• Molecular Weight: 910.50
• CAS Registry Number: 67874-08-2
• EINECS: 267-452-0
• SMILES: CO[S]([O-])(=O)=O.C([N+]1(C(=[NH+]CC1)CCCCCCCCCCCCCCCCCCCCC)C)CN(C(=O)CCCCCCCCCCCCCCCCCCCCC)CCC#N
• InChI: 1S/C52H101N4O.CH4O4S/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-40-43-51-54-46-49-56(51,3)50-48-55(47-42-45-53)52(57)44-41-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2;1-5-6(2,3)4/h4-44,46-50H2,1-3H3;1H3,(H,2,3,4)/q+1
• InChIKey: ZFYBAYJOZWMKNE-UHFFFAOYSA-N