HRID185826

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID80406

2-(4-Chlorophenyl)-2-methylpropanoic acid

C10H11ClO2

HCID21957208

未命名化合物

PRODUCTS

生成物

结构：CC(C)OC(=O)Nc1cccc(C2CCN(CCCNC(=O)C(C)(C)c3ccc(Cl)cc3)CC2)c1

HCID21957200

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-af8a5c2f5ef94e0583430d1b6cc7c9e6
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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