HRID1149803

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6344

Dichloromethane

CH2Cl2

结构：CC(C)(C)OC(=O)NC(CC(=O)O)Cc1cc(F)c(F)cc1F

HCID21911205

未命名化合物

HCID57518481

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1nc(C(F)(F)F)n2c1C(C)N(C(=O)CC(Cc1cc(F)c(F)cc1F)NC(=O)OC(C)(C)C)CC2

HCID76553213

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c5ec677d17ae4de4ace6625c0014fb28
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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