HRID291828

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID23511620

tert-Butyl (piperidin-4-yl)acetate

C11H21NO2

结构：CC(C)(C(=O)O)C(C=Cc1ccccc1)NC(=O)c1ccc(C#N)cc1

HCID70202156

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)CC1CCN(C(=O)C(C)(C)C(C=Cc2ccccc2)NC(=O)c2ccc(C#N)cc2)CC1

HCID86753670

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-97232adeaa24484e905b45545ba38d50
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](#[N:2])[c:3]1[cH:4][cH:5][c:6]([C:7](=[O:8])[NH:9][CH:10]([C:11]([C:12](=[O:13])[OH:14])([CH3:15])[CH3:16])[CH:17]=[CH:18][c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[cH:25][cH:26]1.[C:27]([CH3:28])([CH3:29])([CH3:30])[O:31][C:32]([CH2:33][CH:34]1[CH2:35][CH2:36][NH:37][CH2:38][CH2:39]1)=[O:40]>>[C:1](#[N:2])[c:3]1[cH:4][cH:5][c:6]([C:7](=[O:8])[NH:9][CH:10]([C:11]([C:12](=[O:13])[N:37]2[CH2:36][CH2:35][CH:34]([CH2:33][C:32]([O:31][C:27]([CH3:28])([CH3:29])[CH3:30])=[O:40])[CH2:39][CH2:38]2)([CH3:15])[CH3:16])[CH:17]=[CH:18][c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[cH:25][cH:26]1