HRID1202603

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6344

Dichloromethane

CH2Cl2

结构：Cc1ccc(C(=O)OCc2ccc(C(CN(C)C(=O)OC(C)(C)C)C(=O)Nc3ccc4cnccc4c3)cc2)c(C)c1

HCID59563784

未命名化合物

PRODUCTS

生成物

结构：CNCC(C(=O)Nc1ccc2cnccc2c1)c1ccc(COC(=O)c2ccc(C)cc2C)cc1

HCID59563719

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-bee8d6d4d1e34e14b482bd09d45a3bb8
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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