HRID1206828

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID12957

Propanamide, 2,2-dimethyl-

C5H11NO

结构：CCCCCC(CC(=O)Nc1cc(C(=O)O)ccc1C(C)(C)C)c1ccc(OC)cc1OC

HCID19348635

未命名化合物

PRODUCTS

生成物

结构：CCCCCC(CC(=O)Nc1cc(C(=O)NC(=O)C(C)(C)C)ccc1C(C)(C)C)c1ccc(OC)cc1OC

HCID19348506

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-664a0dc672e44c939550bfc5aecab48b
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

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