HRID2344577

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID1140

Toluene

C7H8

HCID19660

Carbonate

CO3-2

HCID104967

Cesium(1+)

Cs+

2 次

HCID105144

Palladium(2+)

Pd+2

HCID723429

tert-Butyl [(piperidin-4-yl)methyl]carbamate

C11H22N2O2

HCID67234369

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)NCC1CCN(c2cccc3ccc(C4COC(C)(C)O4)nc23)CC1

HCID86654343

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d3f0e1b82b4346a1a08adc2a454ce267
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[Br:1][c:2]1[cH:3][cH:4][cH:5][c:6]2[cH:7][cH:8][c:9]([CH:12]3[O:13][C:14]([CH3:17])([CH3:18])[O:15][CH2:16]3)[n:10][c:11]12.[C:34](=[O:35])([O-:36])[O-:37].[CH3:40][c:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1.[Cs+:38].[Cs+:39].[NH:19]1[CH2:20][CH2:21][CH:22]([CH2:25][NH:26][C:27]([O:28][C:29]([CH3:30])([CH3:31])[CH3:32])=[O:33])[CH2:23][CH2:24]1.[O-:48][C:49]([CH3:50])=[O:51].[O-:52][C:53]([CH3:54])=[O:55].[Pd+2:47]>>[c:2]1([N:19]2[CH2:20][CH2:21][CH:22]([CH2:25][NH:26][C:27]([O:28][C:29]([CH3:30])([CH3:31])[CH3:32])=[O:33])[CH2:23][CH2:24]2)[cH:3][cH:4][cH:5][c:6]2[cH:7][cH:8][c:9]([CH:12]3[O:13][C:14]([CH3:17])([CH3:18])[O:15][CH2:16]3)[n:10][c:11]12