HRID143456

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID6328

Methyl iodide

CH3I

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID11357

2-Ethylaniline

C8H11N

HCID30165

Iodide ion

I-

HCID166653

Hydride

H-

HCID167070

2-Chloro-1-methylpyridinium

C6H7ClN+

HCID16795996

未命名化合物

PRODUCTS

生成物

结构：CCc1ccccc1N(C)C(=O)c1cccnc1Oc1cc(Cl)ccc1Cl

HCID46195125

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9c84da74b7bb43668a7494bcf224c0c3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[CH2:19]([CH3:20])[c:21]1[c:22]([NH2:27])[cH:23][cH:24][cH:25][cH:26]1.[CH3:28][CH2:29][N:30]([CH2:31][CH3:32])[CH2:33][CH3:34].[Cl:1][c:2]1[c:3]([O:4][c:5]2[c:6]([C:7](=[O:8])[OH:9])[cH:10][cH:11][cH:12][n:13]2)[cH:14][c:15]([Cl:18])[cH:16][cH:17]1.[Cl:36][c:37]1[cH:38][cH:39][cH:40][cH:41][n+:42]1[CH3:43].[Cl:48][CH2:49][Cl:50].[H-:44].[I-:35].[I:46][CH3:47].[Na+:45]>>[Cl:1][c:2]1[c:3]([O:4][c:5]2[c:6]([C:7](=[O:9])[N:27]([c:22]3[c:21]([CH2:19][CH3:20])[cH:26][cH:25][cH:24][cH:23]3)[CH3:28])[cH:10][cH:11][cH:12][n:13]2)[cH:14][c:15]([Cl:18])[cH:16][cH:17]1