4-[7-(Diethylamino)-2-Oxo-2H-1-Benzopyran-3-Yl]-1-Methylpyridinium Methyl Sulphate
[CAS# 55470-53-6]

Identification

• Name: 4-[7-(Diethylamino)-2-Oxo-2H-1-Benzopyran-3-Yl]-1-Methylpyridinium Methyl Sulphate
• Synonyms: 7-Diethylamino-3-(1-Methyl-4-Pyridin-1-Iumyl)-2-Chromenone; Methyl Sulfate; 7-Diethylamino-3-(1-Methylpyridin-1-Ium-4-Yl)Coumarin; Methyl Sulfate; 4-(7-(Diethylamino)-2-Oxo-2H-1-Benzopyran-3-Yl)-1-Methylpyridiniummethyl Sulphate
• Molecular Formula: C₂₀H₂₄N₂O₆S
• Molecular Weight: 420.48
• CAS Registry Number: 55470-53-6
• EINECS: 259-655-8
• SMILES: CO[S]([O-])(=O)=O.C2=C1OC(=O)C(=CC1=CC=C2N(CC)CC)C3=CC=[N+](C=C3)C
• InChI: 1S/C19H21N2O2.CH4O4S/c1-4-21(5-2)16-7-6-15-12-17(19(22)23-18(15)13-16)14-8-10-20(3)11-9-14;1-5-6(2,3)4/h6-13H,4-5H2,1-3H3;1H3,(H,2,3,4)/q+1;/p-1
• InChIKey: XUHCZKYTEGBYIW-UHFFFAOYSA-M