HRID149101

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID67430

4-Chlorophenethylamine

C8H10ClN

HCID16038471

未命名化合物

PRODUCTS

产物

HCID68680577

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-b8fb06af866d4daea5b4b6114cae8b03
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应SMILES

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