HRID1560381

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID65578

Ethanedioyl dichloride

C2Cl2O2

HCID605123

2-(4-Fluorophenoxy)nicotinic acid

C12H8FNO3

HCID20872623

4-(Aminomethyl)-3-fluorophenol

C7H8FNO

PRODUCTS

生成物

结构：O=C(NCc1ccc(O)cc1F)c1cccnc1Oc1ccc(F)cc1

HCID17832836

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4fbbda878a7147afbdbd6e851de82517
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

[CH3:18][N:19]([CH3:20])[CH:21]=[O:22].[CH3:43][CH2:44][N:45]([CH2:46][CH3:47])[CH2:48][CH3:49].[Cl:23][C:24]([C:25]([Cl:26])=[O:27])=[O:28].[Cl:40][CH2:41][Cl:42].[ClH:29].[F:1][c:2]1[cH:3][cH:4][c:5]([O:6][c:7]2[c:8]([C:9](=[O:10])[OH:11])[cH:12][cH:13][cH:14][n:15]2)[cH:16][cH:17]1.[F:30][c:31]1[c:32]([CH2:33][NH2:34])[cH:35][cH:36][c:37]([OH:39])[cH:38]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([O:6][c:7]2[c:8]([C:9](=[O:11])[NH:34][CH2:33][c:32]3[c:31]([F:30])[cH:38][c:37]([OH:39])[cH:36][cH:35]3)[cH:12][cH:13][cH:14][n:15]2)[cH:16][cH:17]1