HRID157286

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

结构：O=S(=O)(c1ccccc1)n1c2ccccc2c2c(OCC3CO3)cccc21

HCID11234330

未命名化合物

HCID11821241

N-Benzyl-2-(2-methoxyphenoxy)ethylamine

C16H19NO2

PRODUCTS

生成物

结构：COc1ccccc1OCCN(Cc1ccccc1)CC(O)COc1cccc2c1c1ccccc1n2S(=O)(=O)c1ccccc1

HCID11479206

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ba0cc7871a264785ba4c9d78b8adf36e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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