HRID2160016

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6328

Methyl iodide

CH3I

HCID19660

Carbonate

CO3-2

结构：COc1ccc(-c2noc3ccc(-n4c(=O)cc(C(F)(F)F)[nH]c4=O)cc23)cc1C

HCID70097922

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(-c2noc3ccc(-n4c(=O)cc(C(F)(F)F)n(C)c4=O)cc23)cc1C

HCID70099049

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f35d5892d8d44dd5b94cb51f8dca7910
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[C:31](=[O:32])([O-:33])[O-:34].[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6](-[c:10]2[n:11][o:12][c:13]3[c:14]2[cH:15][c:16](-[n:19]2[c:20](=[O:30])[nH:21][c:22]([C:26]([F:27])([F:28])[F:29])[cH:23][c:24]2=[O:25])[cH:17][cH:18]3)[cH:7][c:8]1[CH3:9].[CH3:37][I:38].[CH3:39][N:40]([CH3:41])[CH:42]=[O:43].[K+:35].[K+:36]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6](-[c:10]2[n:11][o:12][c:13]3[c:14]2[cH:15][c:16](-[n:19]2[c:20](=[O:30])[n:21]([CH3:31])[c:22]([C:26]([F:27])([F:28])[F:29])[cH:23][c:24]2=[O:25])[cH:17][cH:18]3)[cH:7][c:8]1[CH3:9]