HRID958115

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

HCID313

Hydrochloric Acid

ClH

HCID6344

Dichloromethane

CH2Cl2

HCID18959674

2,2-Dimethylmorpholine

C6H13NO

结构：Cc1nc(-c2c(C(C)C)ccc3[nH]ncc23)c2ccc(O)cc2c1C=O

HCID136341660

未命名化合物

PRODUCTS

生成物

结构：Cc1nc(-c2c(C(C)C)ccc3[nH]ncc23)c2ccc(O)cc2c1CN1CCOC(C)(C)C1

HCID136010467

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c61117f65dc6404ebf3b7aff52adbb6d
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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