HRID950233

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID6344

Dichloromethane

CH2Cl2

HCID8857

Ethyl acetate

C4H8O2

HCID17208

Benzyltriethylammonium

C13H22N+

HCID30165

Iodide ion

I-

HCID74499

Trimethylsulfoxonium

C3H9OS+

结构：C=Cc1cc(NC(=O)OC(C)(C)C)c([N+](=O)[O-])cc1C(F)(F)F

HCID69486631

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)Nc1cc(C2CC2)c(C(F)(F)F)cc1[N+](=O)[O-]

HCID69489771

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-360f421de2bc485faa21fd17f48f837f
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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