HRID1135905

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：Cc1cccc(C)c1N(CCCC(=O)O)C(=O)c1ccc(Cl)cc1

HCID35383

Butyric acid, 4-(p-chloro-N-2,6-xylylbenzamido)-

C19H20ClNO3

HCID20292063

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)CCCN(C(=O)CCCN(C(=O)c1ccc(Cl)cc1)c1c(C)cccc1C)c1c(C)cccc1C

HCID20292087

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fcedf1b08a1b4e72ba8737cda605436b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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