HRID320242

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID16028

Tetrabutylammonium

C16H36N+

HCID18358

3-(Chloromethyl)pyridine

C6H6ClN

HCID30165

Iodide ion

I-

HCID166653

Hydride

H-

HCID854140

tert-Butyl 4-(2-hydroxyethyl)piperidine-1-carboxylate

C12H23NO3

PRODUCTS

生成物

HCID59371585

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-179a56c265f8452393b0d92bfea7ce4f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([CH2:14][CH2:15][OH:16])[CH2:12][CH2:13]1.[CH2:35]([N+:36]([CH2:37][CH2:38][CH2:39][CH3:40])([CH2:41][CH2:42][CH2:43][CH3:44])[CH2:45][CH2:46][CH2:47][CH3:48])[CH2:49][CH2:50][CH3:51].[ClH:19].[H-:18].[I-:34].[Na+:17].[O:29]=[CH:30][N:31]([CH3:32])[CH3:33].[OH2:28].[cH:20]1[c:21]([CH2:26][Cl:27])[cH:22][cH:23][cH:24][n:25]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([CH2:14][CH2:15][O:16][CH2:26][c:21]2[cH:20][n:25][cH:24][cH:23][cH:22]2)[CH2:12][CH2:13]1