HRID2132255

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID6422

未命名化合物

结构：COC(=O)c1ccc(Cc2cn(C)c3ccc(C=C(C)C(=O)OC(C)(C)C)cc23)c(OC)c1

HCID67922456

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1ccc(Cc2cn(C)c3ccc(C=C(C)C(=O)O)cc23)c(OC)c1

HCID67834859

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-baf61ee23fd6431b823dfc54d8ce1d3c
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

[C:8]([CH3:9])([CH3:10])([CH3:11])[O:12][C:13](=[O:14])[C:15](=[CH:16][c:17]1[cH:18][c:19]2[c:20]([CH2:27][c:28]3[c:29]([O:38][CH3:39])[cH:30][c:31]([C:32](=[O:33])[O:34][CH3:35])[cH:36][cH:37]3)[cH:21][n:22]([CH3:26])[c:23]2[cH:24][cH:25]1)[CH3:40].[CH2:41]([Cl:42])[Cl:43].[OH:1][C:2]([C:3]([F:4])([F:5])[F:6])=[O:7]>>[O:12]=[C:13]([OH:14])[C:15](=[CH:16][c:17]1[cH:18][c:19]2[c:20]([CH2:27][c:28]3[c:29]([O:38][CH3:39])[cH:30][c:31]([C:32](=[O:33])[O:34][CH3:35])[cH:36][cH:37]3)[cH:21][n:22]([CH3:26])[c:23]2[cH:24][cH:25]1)[CH3:40]