HRID1223535

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID241

Benzene

C6H6

HCID8028

Tetrahydrofuran

C4H8O

HCID78373

Methanamine, 1,1-dimethoxy-N,N-dimethyl-

C5H13NO2

HCID9971073

未命名化合物

HCID57198439

未命名化合物

PRODUCTS

生成物

结构：CCCCC=CC(=O)C(=CNCc1ccc(-c2ccccc2C(=O)OC(C)(C)C)cc1)C(=O)OCC

HCID178444118

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0cdd6f631fe74c048b8ed68855f7ceaa
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

[CH3:15][O:16][CH:17]([O:18][CH3:19])[N:20]([CH3:21])[CH3:22].[NH2:23][CH2:24][c:25]1[cH:26][cH:27][c:28](-[c:31]2[c:32]([C:37](=[O:38])[O:39][C:40]([CH3:41])([CH3:42])[CH3:43])[cH:33][cH:34][cH:35][cH:36]2)[cH:29][cH:30]1.[O:1]=[C:2]([CH2:3][C:4](=[O:5])[O:6][CH2:7][CH3:8])[CH:9]=[CH:10][CH2:11][CH2:12][CH2:13][CH3:14].[O:50]1[CH2:51][CH2:52][CH2:53][CH2:54]1.[cH:44]1[cH:45][cH:46][cH:47][cH:48][cH:49]1>>[O:1]=[C:2]([C:3]([C:4](=[O:5])[O:6][CH2:7][CH3:8])=[CH:15][NH:23][CH2:24][c:25]1[cH:26][cH:27][c:28](-[c:31]2[c:32]([C:37](=[O:38])[O:39][C:40]([CH3:41])([CH3:42])[CH3:43])[cH:33][cH:34][cH:35][cH:36]2)[cH:29][cH:30]1)[CH:9]=[CH:10][CH2:11][CH2:12][CH2:13][CH3:14]