HRID111677

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID1140

Toluene

C7H8

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID166653

Hydride

H-

结构：CCOC(=O)C1=C(C)NC(C)=C(C(=O)OCC)C1c1ccccc1C(F)(F)F

HCID168089

SK&F 24260

C20H22F3NO4

HCID20281064

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C1=C(C)N(CCN(C(C)OC)C(C)OC)C(C)=C(C(=O)OCC)C1c1ccccc1C(F)(F)F

HCID70489418

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-572ed17528c1490997f7eeb9b2418688
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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