HRID298756

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID21935732

未命名化合物

结构：CC(C)(C)OC(=O)C(C)(C)Oc1ccc(CC(=O)O)cc1

HCID67072057

未命名化合物

结构：Cc1nc(-c2ccc(C(F)(F)F)cc2)ccc1NC(=O)OC(C)(C)C

HCID67072248

未命名化合物

PRODUCTS

生成物

结构：Cc1nc(-c2ccc(C(F)(F)F)cc2)ccc1N(C)C(=O)Cc1ccc(OC(C)(C)C(=O)OC(C)(C)C)cc1

HCID69526544

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ce932a43b1c444da810fe313e3f73c43
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:20]([O:21][C:22](=[O:23])[NH:24][c:25]1[c:26]([CH3:27])[n:28][c:29](-[c:30]2[cH:31][cH:32][c:33]([C:34]([F:35])([F:36])[F:37])[cH:38][cH:39]2)[cH:40][cH:41]1)([CH3:42])([CH3:43])[CH3:44].[C:45]([CH3:46])([CH3:47])([CH3:48])[O:49][C:50]([C:51]([CH3:52])([CH3:53])[O:54][c:55]1[cH:56][cH:57][c:58]([CH2:61][C:62](=[O:63])[OH:64])[cH:59][cH:60]1)=[O:65].[CH3:1][NH:2][c:3]1[c:4]([CH3:19])[n:5][c:6](-[c:9]2[cH:10][cH:11][c:12]([C:15]([F:16])([F:17])[F:18])[cH:13][cH:14]2)[cH:7][cH:8]1>>[CH3:1][N:2]([c:3]1[c:4]([CH3:19])[n:5][c:6](-[c:9]2[cH:10][cH:11][c:12]([C:15]([F:16])([F:17])[F:18])[cH:13][cH:14]2)[cH:7][cH:8]1)[C:62]([CH2:61][c:58]1[cH:57][cH:56][c:55]([O:54][C:51]([C:50]([O:49][C:45]([CH3:46])([CH3:47])[CH3:48])=[O:65])([CH3:52])[CH3:53])[cH:60][cH:59]1)=[O:64]