HRID958605

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

3 次

HCID813

Potassium cation

K+

HCID962

Water

H2O

HCID3776

Isopropanol

C3H8O

HCID8471

Triethylamine

C6H15N

HCID27099

Copper(2+)

Cu+2

HCID10998153

未命名化合物

HCID22064516

未命名化合物

PRODUCTS

生成物

结构：COc1cc(Nc2c(C(=O)O)cc3ccccc3c2[N+](=O)[O-])c2c(c1)OC(C)(C)C=C2

HCID22064535

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-05479f3e96194027b4fef9bf08e34b95
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:42]([O-:43])(=[O:44])[CH3:45].[C:47]([O-:48])(=[O:49])[CH3:50].[CH3:34][C:35](=[O:36])[O-:37].[CH3:38][CH:39]([OH:40])[CH3:41].[CH3:52][CH2:53][N:54]([CH2:55][CH3:56])[CH2:57][CH3:58].[Cl:16][c:17]1[c:18]([C:30](=[O:31])[OH:32])[cH:19][c:20]2[cH:21][cH:22][cH:23][cH:24][c:25]2[c:26]1[N+:27](=[O:28])[O-:29].[Cu+2:46].[K+:33].[NH2:1][c:2]1[c:3]2[c:8]([cH:9][c:10]([O:12][CH3:13])[cH:11]1)[O:7][C:6]([CH3:14])([CH3:15])[CH:5]=[CH:4]2.[OH2:51]>>[NH:1]([c:2]1[c:3]2[c:8]([cH:9][c:10]([O:12][CH3:13])[cH:11]1)[O:7][C:6]([CH3:14])([CH3:15])[CH:5]=[CH:4]2)[c:17]1[c:18]([C:30](=[O:31])[OH:32])[cH:19][c:20]2[cH:21][cH:22][cH:23][cH:24][c:25]2[c:26]1[N+:27](=[O:28])[O-:29]