HRID309837

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

HCID102688

Phenylalanine ethyl ester

C11H15NO2

PRODUCTS

生成物

结构：CCOC(=O)C(Cc1ccccc1)NC(=O)CCCN(C(=O)c1ccc(Cl)cc1)c1c(C)cccc1C

HCID178470890

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fa940f44830140c2a95ddf2caa488f0b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[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.[NH2:25][CH:26]([CH2:27][c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1)[C:34](=[O:35])[O:36][CH2:37][CH3:38]>>[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])[NH:25][CH:26]([CH2:27][c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[C:34](=[O:35])[O:36][CH2:37][CH3:38])[cH:23][cH:24]1