HRID178544

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6344

Dichloromethane

CH2Cl2

HCID7972

4-Methylmorpholine

C5H11NO

HCID409715

未命名化合物

HCID2757757

Alanine, N-(4-chlorophenyl)-2-methyl-

C10H12ClNO2

PRODUCTS

生成物

结构：CC(NC(=O)C(C)(C)Nc1ccc(Cl)cc1)C(Cc1ccc(Cl)cc1)c1ccc(Cl)cc1

HCID22270589

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7d37b69946ad43b1af0fad4394832040
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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