HRID959488

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID75550

1,4-Benzenediol, 2,6-bis(1,1-dimethylethyl)-

C14H22O2

HCID166653

Hydride

H-

结构：CN(C(=O)OC(C)(C)C)c1cc(Cl)ccc1[N+](=O)[O-]

HCID15544598

未命名化合物

PRODUCTS

生成物

结构：CN(C(=O)OC(C)(C)C)c1cc(Oc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)ccc1[N+](=O)[O-]

HCID18461307

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3bbe2446c704467ebff9178c2d330be2
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])[c:5]1[c:6]([OH:7])[c:8]([C:13]([CH3:14])([CH3:15])[CH3:16])[cH:9][c:10]([OH:12])[cH:11]1.[CH3:38][N:39]([CH3:40])[CH:41]=[O:42].[Cl:17][c:18]1[cH:19][cH:20][c:21]([N+:33](=[O:34])[O-:35])[c:22]([N:24]([C:25]([O:26][C:27]([CH3:28])([CH3:29])[CH3:30])=[O:31])[CH3:32])[cH:23]1.[H-:36].[Na+:37]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([OH:7])[c:8]([C:13]([CH3:14])([CH3:15])[CH3:16])[cH:9][c:10]([O:12][c:18]2[cH:19][cH:20][c:21]([N+:33](=[O:34])[O-:35])[c:22]([N:24]([C:25]([O:26][C:27]([CH3:28])([CH3:29])[CH3:30])=[O:31])[CH3:32])[cH:23]2)[cH:11]1