HRID2340453

反应详情

EQUATION

反应方程式

REACTANTS

反应物

反应SMILES：Cc1cc(-c2cccc(C(=O)CC(=O)OC(C)(C)C)c2)cc(C)n1

HCID69489240

未命名化合物

反应SMILES：CC(C)(C)OC(=O)Nc1ccc(OC(F)(F)F)cc1N

HCID69489489

未命名化合物

PRODUCTS

产物

反应SMILES：Cc1cc(-c2cccc(C(=O)CC(=O)Nc3cc(OC(F)(F)F)ccc3NC(=O)OC(C)(C)C)c2)cc(C)n1

HCID86589377

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-156ce4184e91486681af8e5b1a8f1589
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[c:9]([NH2:19])[cH:10][c:11]([O:14][C:15]([F:16])([F:17])[F:18])[cH:12][cH:13]1)=[O:20].[C:21]([CH3:23])([CH3:24])([O:25][C:26](=[O:22])[CH2:27][C:28](=[O:29])[c:30]1[cH:31][c:32](-[c:36]2[cH:37][c:38]([CH3:43])[n:39][c:40]([CH3:42])[cH:41]2)[cH:33][cH:34][cH:35]1)[CH3:44]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[c:9]([NH:19][C:26](=[O:25])[CH2:27][C:28](=[O:29])[c:30]2[cH:31][c:32](-[c:36]3[cH:37][c:38]([CH3:43])[n:39][c:40]([CH3:42])[cH:41]3)[cH:33][cH:34][cH:35]2)[cH:10][c:11]([O:14][C:15]([F:16])([F:17])[F:18])[cH:12][cH:13]1)=[O:20]