HRID1537184

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID313

Hydrochloric Acid

ClH

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID6344

Dichloromethane

CH2Cl2

HCID17208

Benzyltriethylammonium

C13H22N+

HCID18358

3-(Chloromethyl)pyridine

C6H6ClN

HCID20660503

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C(C)(Cc1cccnc1)S(=O)(=O)c1ccc(OC)cc1

HCID11046694

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9ebaf7fcb9b74b739a9de5b4a88eda8b
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

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