HRID2346780

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID19660

Carbonate

CO3-2

HCID2734649

2,6-Dimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol

C14H21BO3

结构：CC(C)(C)OC(=O)N1CC=C(OS(=O)(=O)C(F)(F)F)CC1

HCID10991161

tert-Butyl 4-[(trifluoromethanesulfonyl)oxy]-3,6-dihydropyridine-1(2H)-carboxylate

C11H16F3NO5S

PRODUCTS

生成物

结构：Cc1cc(C2=CCN(C(=O)OC(C)(C)C)CC2)cc(C)c1O

HCID67304025

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-82458f87de2b4d2898926a45176d45d1
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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