3-[ethyl-[3-methyl-4-[(E)-2-(1,3,3-trimethylindol-1-ium-2-yl)vinyl]phenyl]amino]propanenitrile phosphate
[CAS# 72208-20-9]

Identification

• Name: 3-[ethyl-[3-methyl-4-[(E)-2-(1,3,3-trimethylindol-1-ium-2-yl)vinyl]phenyl]amino]propanenitrile phosphate
• Synonyms: 2-[2-[4-[(2-cyanoethyl)ethylamino]-o-tolyl]vinyl]-1,3,3-trimethyl-3H-indolium dihydrogen phosphate
• Molecular Formula: C₂₅H₃₀N₃O₄P
• Molecular Weight: 467.50
• CAS Registry Number: 72208-20-9
• EINECS: 276-470-8
• SMILES: [O-]P([O-])([O-])=O.CCN(CCC#N)c3ccc(/C=C/C2=[N+](C)c1ccccc1C2(C)C)c(C)c3
• InChI: 1S/C25H30N3.H3O4P/c1-6-28(17-9-16-26)21-14-12-20(19(2)18-21)13-15-24-25(3,4)22-10-7-8-11-23(22)27(24)5;1-5(2,3)4/h7-8,10-15,18H,6,9,17H2,1-5H3;(H3,1,2,3,4)/q+1;/p-3
• InChIKey: WIUVJBSMLKSOOV-UHFFFAOYSA-K