HRID2320457

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID69460

1,2,3,4-Tetrahydroquinoline

C9H11N

结构：COC(=O)C(CC(C)C)c1cc(OS(=O)(=O)C(F)(F)F)cc(-c2ccc(C(F)(F)F)cc2)c1

HCID59004769

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C(CC(C)C)c1cc(-c2ccc(C(F)(F)F)cc2)cc(N2CCCc3ccccc32)c1

HCID57666604

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d4f55539c2024244ad6b492a26cc3e7d
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

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