HRID135429

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8150

Diethylene glycol dimethyl ether

C6H14O3

HCID459610

4-Chloro-6,7-dimethoxyquinoline

C11H10ClNO2

HCID22132694

(4-Hydroxyphenyl)[3-(trifluoromethyl)phenyl]methanone

C14H9F3O2

PRODUCTS

生成物

结构：COc1cc2nccc(Oc3ccc(C(=O)c4cccc(C(F)(F)F)c4)cc3)c2cc1OC

HCID22132736

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8b592c18b6034353a424ef478504abfc
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

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