[3-[[2-Cyano-3-[4-(Diethylamino)Phenyl]-1-Oxoallyl]Oxy]Propyl](2-Hydroxyethyl)Dimethylammonium Chloride
[CAS# 93981-78-3]

Identification

• Name: [3-[[2-Cyano-3-[4-(Diethylamino)Phenyl]-1-Oxoallyl]Oxy]Propyl](2-Hydroxyethyl)Dimethylammonium Chloride
• Synonyms: 3-[(E)-2-Cyano-3-(4-Diethylaminophenyl)Prop-2-Enoyl]Oxypropyl-(2-Hydroxyethyl)-Dimethyl-Ammonium Chloride; 3-[(E)-2-Cyano-3-(4-Diethylaminophenyl)-1-Oxoprop-2-Enoxy]Propyl-(2-Hydroxyethyl)-Dimethylammonium Chloride; 3-[(E)-2-Cyano-3-(4-Diethylaminophenyl)Ac
• Molecular Formula: C₂₁H₃₂ClN₃O₃
• Molecular Weight: 409.96
• CAS Registry Number: 93981-78-3
• EINECS: 301-165-4
• SMILES: C1=C(N(CC)CC)C=CC(=C1)/C=C(/C(OCCC[N+](CCO)(C)C)=O)C#N.[Cl-]
• InChI: 1S/C21H32N3O3.ClH/c1-5-23(6-2)20-10-8-18(9-11-20)16-19(17-22)21(26)27-15-7-12-24(3,4)13-14-25;/h8-11,16,25H,5-7,12-15H2,1-4H3;1H/q+1;/p-1/b19-16+
• InChIKey: AXTWRHHHMPIWSA-PXMDEAMVSA-M