HRID207189

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID27099

Copper(2+)

Cu+2

HCID79599

4-Bromophenylboric acid

C6H6BBrO2

结构：Cc1c(N(Cc2ccc(O)cc2)Cc2ccc(F)cc2F)cccc1[N+](=O)[O-]

HCID18512160

未命名化合物

PRODUCTS

生成物

结构：Cc1c(N(Cc2ccc(Oc3ccc(Br)cc3)cc2)Cc2ccc(F)cc2F)cccc1[N+](=O)[O-]

HCID18511981

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-af61a9c2bdab4d72ba7b3399b9afe755
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[Br:29][c:30]1[cH:31][cH:32][c:33]([B:36]([OH:37])[OH:38])[cH:34][cH:35]1.[C:49]([O-:50])(=[O:51])[CH3:52].[C:54]([O-:55])(=[O:56])[CH3:57].[CH3:39][CH2:40][N:41]([CH2:42][CH3:43])[CH2:44][CH3:45].[Cl:46][CH2:47][Cl:48].[Cu+2:53].[F:1][c:2]1[c:3]([CH2:4][N:5]([c:6]2[c:7]([CH3:15])[c:8]([N+:12](=[O:13])[O-:14])[cH:9][cH:10][cH:11]2)[CH2:16][c:17]2[cH:18][cH:19][c:20]([OH:23])[cH:21][cH:22]2)[cH:24][cH:25][c:26]([F:28])[cH:27]1>>[F:1][c:2]1[c:3]([CH2:4][N:5]([c:6]2[c:7]([CH3:15])[c:8]([N+:12](=[O:13])[O-:14])[cH:9][cH:10][cH:11]2)[CH2:16][c:17]2[cH:18][cH:19][c:20]([O:23][c:33]3[cH:32][cH:31][c:30]([Br:29])[cH:35][cH:34]3)[cH:21][cH:22]2)[cH:24][cH:25][c:26]([F:28])[cH:27]1