HRID99366

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID12176

Glycine ethyl ester

C4H9NO2

HCID21885

2-Dimethylaminopyridine

C7H10N2

HCID31275

1,4-Dioxane

C4H8O2

HCID20475770

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)CNC(=O)c1ccc(NCCCCCCCCC2CCCCC2)cc1

HCID20475823

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9336560564214d03b9d45f733e15ed5f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH3:39][N:40]([c:41]1[cH:42][cH:43][cH:44][cH:45][n:46]1)[CH3:47].[CH3:48][CH2:49][N:50]([CH2:51][CH3:52])[CH2:53][CH3:54].[CH:2]1([CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][NH:16][c:17]2[cH:18][cH:19][c:20]([C:21](=[O:22])[Cl:23])[cH:24][cH:25]2)[CH2:3][CH2:4][CH2:5][CH2:6][CH2:7]1.[Cl:55][CH2:56][Cl:57].[ClH:1].[NH2:32][CH2:33][C:34](=[O:35])[O:36][CH2:37][CH3:38].[O:26]1[CH2:27][CH2:28][O:29][CH2:30][CH2:31]1>>[CH:2]1([CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][NH:16][c:17]2[cH:18][cH:19][c:20]([C:21](=[O:22])[NH:32][CH2:33][C:34](=[O:35])[O:36][CH2:37][CH3:38])[cH:24][cH:25]2)[CH2:3][CH2:4][CH2:5][CH2:6][CH2:7]1