HRID1237917

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CCOC(=O)C(C)c1ccc(B2OC(C)(C)C(C)(C)O2)cc1

HCID58539349

未命名化合物

结构：Cc1cc(-c2onc(C)c2NC(=O)OC(C)c2ccccc2F)ccc1Br

HCID76191771

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C(C)c1ccc(-c2ccc(-c3onc(C)c3NC(=O)OC(C)c3ccccc3F)cc2C)cc1

HCID67352634

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1fb8cc5a9ddd472cb5be42149c5b6fa6
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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