HRID2157244

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

HCID19660

Carbonate

CO3-2

HCID76300

Ethyl 4-bromobutyrate

C6H11BrO2

结构：CCCC(CCCCCCC(=O)c1c[nH]c2ccccc12)c1ccc(CC(C)C)cc1

HCID22400457

未命名化合物

PRODUCTS

生成物

结构：CCCC(CCCCCCC(=O)c1cn(CCCC(=O)OCC)c2ccccc12)c1ccc(CC(C)C)cc1

HCID22400460

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1ef2c09f9f674d8ab289b48374833e31
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

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