HRID936710

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID8857

Ethyl acetate

C4H8O2

HCID9590

1-Fluoro-4-nitrobenzene

C6H4FNO2

HCID19660

Carbonate

CO3-2

结构：COC(=O)Cc1ccc(O)c(CNC(=O)OC(C)(C)C)c1

HCID68467019

未命名化合物

PRODUCTS

生成物

结构：COC(=O)Cc1ccc(Oc2ccc([N+](=O)[O-])cc2)c(CNC(=O)OC(C)(C)C)c1

HCID68464706

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7a4b8e80ecbb4b23b49f6a21532af936
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:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH2:9][c:10]1[cH:11][c:12]([CH2:17][C:18](=[O:19])[O:20][CH3:21])[cH:13][cH:14][c:15]1[OH:16].[CH3:38][CH2:39][O:40][C:41](=[O:42])[CH3:43].[F:28][c:29]1[cH:30][cH:31][c:32]([N+:35](=[O:36])[O-:37])[cH:33][cH:34]1.[K+:22].[K+:23].[O-:24][C:25]([O-:26])=[O:27].[OH2:44]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH2:9][c:10]1[cH:11][c:12]([CH2:17][C:18](=[O:19])[O:20][CH3:21])[cH:13][cH:14][c:15]1[O:16][c:29]1[cH:30][cH:31][c:32]([N+:35](=[O:36])[O-:37])[cH:33][cH:34]1