HRID2328625

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

HCID2734314

4-Benzyloxyphenylboronic acid

C13H13BO3

HCID24728173

4-Bromo-6-fluoro-1H-indole

C8H5BrFN

PRODUCTS

产物

反应SMILES：Fc1cc(Br)c2ccn(-c3ccc(OCc4ccccc4)cc3)c2c1

HCID59627933

4-Bromo-6-fluoro-1-[4-(phenylmethoxy)phenyl]-1H-indole

C21H15BrFNO

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-7c3b11cc3d6e4ae897e62fc73014ec0b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应SMILES

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