HRID319050

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID7912

Diisopropylamine

C6H15N

HCID58689895

未命名化合物

结构：O=C(O)COc1ccc(F)cc1-c1ccccc1OC(F)(F)F

HCID58689904

未命名化合物

PRODUCTS

生成物

结构：CC(C)N(NC(=O)C1CCOCC1)C(=O)COc1ccc(F)cc1-c1ccccc1OC(F)(F)F

HCID11569570

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6ef78dbcc58a4fa7935441346e32a7b4
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

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