HRID671423

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

3 次

HCID6342

Acetonitrile

C2H3N

HCID19660

Carbonate

CO3-2

HCID30165

Iodide ion

I-

HCID4522296

未命名化合物

HCID10608971

1-(2-Methoxyphenyl)-4-piperidinemethanamine

C13H20N2O

PRODUCTS

生成物

结构：COc1ccccc1N1CCC(CNCC2COc3ccccc3O2)CC1

HCID19079006

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8abb4f2c4d034f12ac1fd07529e86c69
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[C:39](=[O:40])([O-:41])[O-:42].[CH3:1][O:2][c:3]1[c:4]([N:9]2[CH2:10][CH2:11][CH:12]([CH2:15][NH2:16])[CH2:13][CH2:14]2)[cH:5][cH:6][cH:7][cH:8]1.[CH3:47][C:48]#[N:49].[I-:46].[K+:43].[K+:44].[K+:45].[c:17]1([CH3:18])[cH:19][cH:20][c:21]([S:22]([O:23][CH2:27][CH:28]2[CH2:29][O:30][c:31]3[c:32]([cH:34][cH:35][cH:36][cH:37]3)[O:33]2)(=[O:24])=[O:25])[cH:26][cH:38]1>>[CH3:1][O:2][c:3]1[c:4]([N:9]2[CH2:10][CH2:11][CH:12]([CH2:15][NH:16][CH2:27][CH:28]3[CH2:29][O:30][c:31]4[c:32]([cH:34][cH:35][cH:36][cH:37]4)[O:33]3)[CH2:13][CH2:14]2)[cH:5][cH:6][cH:7][cH:8]1