HRID212386

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID962

Water

H2O

HCID7521

2-Vinylpyridine

C7H7N

HCID16028

Tetrabutylammonium

C16H36N+

HCID68558507

未命名化合物

PRODUCTS

生成物

结构：CN1CCc2c(n(CCc3ccccn3)c3ccc(Cl)cc23)CC1

HCID59368501

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-49b1b25429f542c89a2f83b9fa5c4066
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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