HRID318195

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID8868

Ethyl acetoacetate

C6H10O3

反应SMILES：CCn1nnnc1C(C=CC=O)=C(c1ccc(F)cc1)c1ccc(F)cc1

HCID54555804

未命名化合物

PRODUCTS

产物

反应SMILES：CCOC(=O)CC(=O)CC(O)C=CC(=C(c1ccc(F)cc1)c1ccc(F)cc1)c1nnnn1CC

HCID86743727

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-bf35621891d940489da8fca5e7053bf9
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

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