HRID305970

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID69486983

未命名化合物

结构：CCc1ccc(-c2cccc(C(=O)CC(=O)OC(C)(C)C)c2)cn1

HCID69489812

1,1-Dimethylethyl 3-(6-ethyl-3-pyridinyl)-β-oxobenzenepropanoate

C20H23NO3

PRODUCTS

生成物

结构：CCc1ccc(-c2cccc(C(=O)CC(=O)Nc3cc(Cl)c(C)cc3NC(=O)OC(C)(C)C)c2)cn1

HCID86589355

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1987ad2036364299bf5c7acd94c6bdb5
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:18]([CH3:20])([CH3:21])([O:22][C:23](=[O:19])[CH2:24][C:25](=[O:26])[c:27]1[cH:28][c:29](-[c:33]2[cH:34][n:35][c:36]([CH2:39][CH3:40])[cH:37][cH:38]2)[cH:30][cH:31][cH:32]1)[CH3:41].[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[c:9]([NH2:16])[cH:10][c:11]([Cl:15])[c:12]([CH3:14])[cH:13]1)=[O:17]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[c:9]([NH:16][C:23](=[O:22])[CH2:24][C:25](=[O:26])[c:27]2[cH:28][c:29](-[c:33]3[cH:34][n:35][c:36]([CH2:39][CH3:40])[cH:37][cH:38]3)[cH:30][cH:31][cH:32]2)[cH:10][c:11]([Cl:15])[c:12]([CH3:14])[cH:13]1)=[O:17]