HRID1123407

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

HCID15233463

4-(3-Bromopropoxy)-1,1'-biphenyl

C15H15BrO

结构：CC(C)(C)OC(=O)CCc1ccc(O)cc1CNC(=O)c1ccccc1

HCID58979520

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)CCc1ccc(OCCCOc2ccc(-c3ccccc3)cc2)cc1CNC(=O)c1ccccc1

HCID69232019

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-10b8844d87b744e6bbe99d8948456d94
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[Br:1][CH2:2][CH2:3][CH2:4][O:5][c:6]1[cH:7][cH:8][c:9](-[c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[cH:10][cH:11]1.[C:18]([CH3:19])([CH3:20])([CH3:21])[O:22][C:23]([CH2:24][CH2:25][c:26]1[c:27]([CH2:33][NH:34][C:35]([c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)=[O:42])[cH:28][c:29]([OH:32])[cH:30][cH:31]1)=[O:43].[K+:44].[K+:45].[O-:46][C:47]([O-:48])=[O:49].[O:50]=[CH:51][N:52]([CH3:53])[CH3:54].[OH2:55]>>[CH2:2]([CH2:3][CH2:4][O:5][c:6]1[cH:7][cH:8][c:9](-[c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[cH:10][cH:11]1)[O:32][c:29]1[cH:28][c:27]([CH2:33][NH:34][C:35]([c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)=[O:42])[c:26]([CH2:25][CH2:24][C:23]([O:22][C:18]([CH3:19])([CH3:20])[CH3:21])=[O:43])[cH:31][cH:30]1