HRID1218504

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CON(C)C(=O)C(Cc1cc(F)ccc1F)NC(=O)OC(C)(C)C

HCID59799812

未命名化合物

HCID59804554

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)NC(=O)c1ccc(Cl)cc1CC(=O)C(Cc1cc(F)ccc1F)NC(=O)OC(C)(C)C

HCID77604948

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-253c46cae013454a9ec7a31e2d064410
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

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