HRID2137215

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID20369

Cinnamylamine, (E)-

C9H11N

HCID30165

Iodide ion

I-

HCID167070

2-Chloro-1-methylpyridinium

C6H7ClN+

结构：CC1=C(C(=O)O)C(c2cccc(Cl)c2)C([N+](=O)[O-])=C(C)N1

HCID18318293

未命名化合物

PRODUCTS

生成物

结构：CC1=C(C(=O)NCC=Cc2ccccc2)C(c2cccc(Cl)c2)C([N+](=O)[O-])=C(C)N1

HCID85050797

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-262b9a4a488a46738a73cc07a9fd1a72
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[CH2:22]([CH:23]=[CH:24][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1)[NH2:31].[CH3:41][CH2:42][N:43]([CH2:44][CH3:45])[CH2:46][CH3:47].[Cl:1][c:2]1[cH:3][c:4]([CH:8]2[C:9]([C:19](=[O:20])[OH:21])=[C:10]([CH3:18])[NH:11][C:12]([CH3:17])=[C:13]2[N+:14](=[O:15])[O-:16])[cH:5][cH:6][cH:7]1.[Cl:33][c:34]1[cH:35][cH:36][cH:37][cH:38][n+:39]1[CH3:40].[I-:32].[O:48]=[CH:49][N:50]([CH3:51])[CH3:52]>>[Cl:1][c:2]1[cH:3][c:4]([CH:8]2[C:9]([C:19](=[O:20])[NH:31][CH2:22][CH:23]=[CH:24][c:25]3[cH:26][cH:27][cH:28][cH:29][cH:30]3)=[C:10]([CH3:18])[NH:11][C:12]([CH3:17])=[C:13]2[N+:14](=[O:15])[O-:16])[cH:5][cH:6][cH:7]1