HRID121853

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID311

Citric acid

C6H8O7

HCID312

Chloride

Cl-

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID15371

2-Propenoic acid, 3-(4-chlorophenyl)-

C9H7ClO2

HCID28486

Lithium ion

Li+

HCID65578

Ethanedioyl dichloride

C2Cl2O2

HCID559668

4-Benzyl-1,3-oxazolidin-2-one

C10H11NO2

PRODUCTS

生成物

结构：O=C(C=Cc1ccc(Cl)cc1)N1C(=O)OCC1Cc1ccccc1

HCID68516357

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-99fe5fa2bfc04160a4b2e379af8f0ef4
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

[CH2:24]([c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1)[CH:31]1[NH:32][C:33](=[O:36])[O:34][CH2:35]1.[CH3:19][N:20]([CH3:21])[CH:22]=[O:23].[CH3:37][CH2:38][N:39]([CH2:40][CH3:41])[CH2:42][CH3:43].[Cl-:45].[Cl:1][C:2]([C:3]([Cl:4])=[O:5])=[O:6].[Cl:46][CH2:47][Cl:48].[Cl:7][c:8]1[cH:9][cH:10][c:11]([CH:14]=[CH:15][C:16](=[O:17])[OH:18])[cH:12][cH:13]1.[Li+:44].[OH2:62].[OH:49][C:50]([CH2:51][C:52]([C:53](=[O:54])[OH:55])([CH2:56][C:57](=[O:58])[OH:59])[OH:60])=[O:61]>>[Cl:7][c:8]1[cH:9][cH:10][c:11]([CH:14]=[CH:15][C:16](=[O:18])[N:32]2[CH:31]([CH2:24][c:25]3[cH:26][cH:27][cH:28][cH:29][cH:30]3)[CH2:35][O:34][C:33]2=[O:36])[cH:12][cH:13]1