HRID1228045

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID8028

Tetrahydrofuran

C4H8O

HCID166653

Hydride

H-

HCID10753531

2-Bromo-N-methyl-N-(2-phenylethyl)acetamide

C11H14BrNO

结构：Cc1c(C(=O)OC(C)C)ncc2[nH]c3cccc(OCc4ccccc4)c3c12

HCID54187064

未命名化合物

PRODUCTS

生成物

结构：Cc1c(C(=O)OC(C)C)ncc2c1c1c(OCc3ccccc3)cccc1n2CC(=O)N(C)CCc1ccccc1

HCID86753863

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b68e0e9308874d41a5198901aade0106
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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