2-[2-[4-[(2-Cyanoethyl)Methylamino]Phenyl]Vinyl]-1,3,3-Trimethyl-3H-Indolium Methyl Sulphate
[CAS# 85187-82-2]

Identification

• Name: 2-[2-[4-[(2-Cyanoethyl)Methylamino]Phenyl]Vinyl]-1,3,3-Trimethyl-3H-Indolium Methyl Sulphate
• Synonyms: Methyl Sulfate; 4-[[4-[(E)-2-(1,3,3-Trimethylindol-1-Ium-2-Yl)Vinyl]Phenyl]Amino]Butanenitrile; Methyl Sulfate; 4-[[4-[(E)-2-(1,3,3-Trimethyl-2-Indol-1-Iumyl)Vinyl]Phenyl]Amino]Butanenitrile; Methyl Sulfate; 4-[[4-[(E)-2-(1,3,3-Trimethylindol-1-Ium-2-Yl)Vinyl]Phenyl]Amino]Butyronitrile
• Molecular Formula: C₂₄H₂₉N₃O₄S
• Molecular Weight: 455.57
• CAS Registry Number: 85187-82-2
• EINECS: 286-170-9
• SMILES: CO[S]([O-])(=O)=O.C2=C1C(C(=[N+](C1=CC=C2)C)C=CC3=CC=C(NCCCC#N)C=C3)(C)C
• InChI: 1S/C23H25N3.CH4O4S/c1-23(2)20-8-4-5-9-21(20)26(3)22(23)15-12-18-10-13-19(14-11-18)25-17-7-6-16-24;1-5-6(2,3)4/h4-5,8-15H,6-7,17H2,1-3H3;1H3,(H,2,3,4)
• InChIKey: PJHFZQGPQJIDNC-UHFFFAOYSA-N