HRID1539741

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID19660

Carbonate

CO3-2

HCID31275

1,4-Dioxane

C4H8O2

HCID104967

Cesium(1+)

Cs+

2 次

HCID22132396

4-Bromo-1-methylpyridin-2(1H)-one

C6H6BrNO

结构：CC(c1ccc(B2OC(C)(C)C(C)(C)O2)cc1)N1CCC(CCCO)(c2ccccc2)OC1=O

HCID72344311

未命名化合物

PRODUCTS

生成物

结构：CC(c1ccc(-c2ccn(C)c(=O)c2)cc1)N1CCC(CCCO)(c2ccccc2)OC1=O

HCID72344394

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3418380ee10d4750a274ce4335ae49b7
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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