HRID120717

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID3283

Diethyl Ether

C4H10O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID98116

(3-Bromo-1-propen-1-yl)benzene

C9H9Br

HCID166653

Hydride

H-

结构：Cc1c(N(Cc2ccc(O)cc2)Cc2ccc(F)cc2F)cccc1[N+](=O)[O-]

HCID18512160

未命名化合物

PRODUCTS

生成物

结构：Cc1c(N(Cc2ccc(OCC=Cc3ccccc3)cc2)Cc2ccc(F)cc2F)cccc1[N+](=O)[O-]

HCID68857423

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-16f7c15586624cba8f3f00ce38b70526
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

[CH2:31]([CH:32]=[CH:33][c:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1)[Br:40].[CH3:46][CH2:47][O:48][CH2:49][CH3:50].[F:1][c:2]1[c:3]([CH2:4][N:5]([c:6]2[c:7]([CH3:15])[c:8]([N+:12](=[O:13])[O-:14])[cH:9][cH:10][cH:11]2)[CH2:16][c:17]2[cH:18][cH:19][c:20]([OH:23])[cH:21][cH:22]2)[cH:24][cH:25][c:26]([F:28])[cH:27]1.[H-:29].[Na+:30].[O:41]=[CH:42][N:43]([CH3:44])[CH3:45]>>[F:1][c:2]1[c:3]([CH2:4][N:5]([c:6]2[c:7]([CH3:15])[c:8]([N+:12](=[O:13])[O-:14])[cH:9][cH:10][cH:11]2)[CH2:16][c:17]2[cH:18][cH:19][c:20]([O:23][CH2:31][CH:32]=[CH:33][c:34]3[cH:35][cH:36][cH:37][cH:38][cH:39]3)[cH:21][cH:22]2)[cH:24][cH:25][c:26]([F:28])[cH:27]1