HRID315032

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID65578

Ethanedioyl dichloride

C2Cl2O2

HCID1810581

2-(Benzyloxy)benzoic acid

C14H12O3

HCID2737646

3-Amino-2-chloro-6-(trifluoromethyl)pyridine

C6H4ClF3N2

PRODUCTS

生成物

结构：O=C(Nc1ccc(C(F)(F)F)nc1Cl)c1ccccc1OCc1ccccc1

HCID59783606

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5a1b651a70b242c0b1d7bd5bd4c3df99
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([C:11](=[O:12])[OH:13])[cH:14][cH:15][cH:16][cH:17]1.[CH2:48]1[O:49][CH2:50][CH2:51][CH2:52]1.[CH3:41][CH2:42][N:43]([CH2:44][CH3:45])[CH2:46][CH3:47].[CH3:53][c:54]1[cH:55][cH:56][cH:57][cH:58][cH:59]1.[Cl:18][C:19]([C:20]([Cl:21])=[O:22])=[O:23].[Cl:29][c:30]1[n:31][c:32]([C:37]([F:38])([F:39])[F:40])[cH:33][cH:34][c:35]1[NH2:36].[O:24]=[CH:25][N:26]([CH3:27])[CH3:28]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([C:11](=[O:13])[NH:36][c:35]2[c:30]([Cl:29])[n:31][c:32]([C:37]([F:38])([F:39])[F:40])[cH:33][cH:34]2)[cH:14][cH:15][cH:16][cH:17]1