HRID93741

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID3283

Diethyl Ether

C4H10O

HCID6212

Chloroform

CHCl3

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6340

Ethane, iodo-

C2H5I

HCID8058

n-Hexane

C6H14

HCID166653

Hydride

H-

结构：O=c1[nH]c(=O)n2c3c1cnn3C(c1cccc(C(F)(F)F)c1)=CC2

HCID15044076

未命名化合物

PRODUCTS

生成物

结构：CCn1c(=O)c2cnn3c2n(c1=O)CC=C3c1cccc(C(F)(F)F)c1

HCID20058375

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-535c9c5da72d4835815f7851946ffeaf
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

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