HRID89851

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID13594

2-Cyclohexen-1-one

C6H8O

HCID105144

Palladium(2+)

Pd+2

HCID13371549

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)c1ncc2[nH]c3ccc(C4=CC(=O)CCC4)cc3c2c1C

HCID54355981

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e09bd9475e244365a7e70834c48d64b8
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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