HRID2144636

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID66724

[1,1'-Biphenyl]-4-carboxylic acid

C13H10O2

结构：CCOC(Cc1ccc(-c2cccc(CNC)c2)cc1)C(=O)OC

HCID68851535

未命名化合物

PRODUCTS

生成物

结构：CCOC(Cc1ccc(-c2cccc(CN(C)C(=O)c3ccc(-c4ccccc4)cc3)c2)cc1)C(=O)OC

HCID90740473

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8091d32c88cf443a9b310f46ff0aa489
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

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