HRID313177

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID313

Hydrochloric Acid

ClH

HCID6344

Dichloromethane

CH2Cl2

HCID7972

4-Methylmorpholine

C5H11NO

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID19883461

未命名化合物

HCID25137682

3,4-Dichloro-5-methyl-1H-pyrrole-2-carboxylic acid

C6H5Cl2NO2

PRODUCTS

生成物

结构：CCOC(=O)N1CCC(NC(=O)c2[nH]c(C)c(Cl)c2Cl)C(OCC)C1

HCID72274476

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-29a8b8523fc04576a3aaba370fe45e4c
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

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