HRID2133203

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID284

Formic acid

CH2O2

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID15413

Methyl tert-butyl ether

C5H12O

结构：CCOC(=O)CC(=O)C=Cc1c(-c2ccc(F)cc2)c2ccccc2n1C(C)C

HCID69239377

未命名化合物

PRODUCTS

生成物

HCID69239723

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3e5bef897ac649c1acce62f79eb9ee19
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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