HRID1225652

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID923

Sodium ion

Na+

2 次

HCID17587

N,N-Dimethylacrylamide

C5H9NO

HCID19660

Carbonate

CO3-2

HCID31374

Dimethylacetamide

C4H9NO

HCID105144

Palladium(2+)

Pd+2

结构：COC(=O)c1cc(Br)cc2c1OC(c1ccccc1)(c1ccccc1)O2

HCID59642990

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1cc(C=CC(=O)N(C)C)cc2c1OC(c1ccccc1)(c1ccccc1)O2

HCID69223918

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d5efa2c722d042fb8525cfd5b1fdb5b9
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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