HRID690896

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID8028

Tetrahydrofuran

C4H8O

HCID59364357

未命名化合物

HCID59364380

未命名化合物

HCID178418306

未命名化合物

PRODUCTS

生成物

结构：CN(CCC(=O)c1cc(F)ccc1C1=NC(C)(C)CO1)C(=O)OC(C)(C)C

HCID59364358

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c44688062db944e68fbd7b7f82d21a30
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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