HRID152673

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID602761

1-(p-Chlorophenyl)cyclobutanecarboxylic acid

C11H11ClO2

HCID16757468

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(NC(=O)C(C)C)cc1C1CCN(CCCNC(=O)C2(c3ccc(Cl)cc3)CCC2)CC1

HCID21957133

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c881fc4411ec453dbb5dacf86cb82770
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]1[cH:3][cH:4][c:5]([C:8]2([C:12](=[O:13])[OH:14])[CH2:9][CH2:10][CH2:11]2)[cH:6][cH:7]1.[NH2:15][CH2:16][CH2:17][CH2:18][N:19]1[CH2:20][CH2:21][CH:22]([c:25]2[cH:26][c:27]([NH:32][C:33]([CH:34]([CH3:35])[CH3:36])=[O:37])[cH:28][cH:29][c:30]2[CH3:31])[CH2:23][CH2:24]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]2([C:12](=[O:14])[NH:15][CH2:16][CH2:17][CH2:18][N:19]3[CH2:20][CH2:21][CH:22]([c:25]4[cH:26][c:27]([NH:32][C:33]([CH:34]([CH3:35])[CH3:36])=[O:37])[cH:28][cH:29][c:30]4[CH3:31])[CH2:23][CH2:24]3)[CH2:9][CH2:10][CH2:11]2)[cH:6][cH:7]1