HRID697817

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID180

Acetone

C3H6O

HCID923

Sodium ion

Na+

2 次

HCID962

Water

H2O

HCID6386

tert-Butyl alcohol

C4H10O

HCID30318

Osmium tetroxide

O4Os

HCID82029

4-Methylmorpholine 4-oxide

C5H11NO2

HCID104748

Sulfurous acid, ion(1-)

HO3S-

HCID167232

Periodate ion

IO4-

结构：C=CCC(CN(C)C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccc(F)cc1

HCID178446393

未命名化合物

PRODUCTS

生成物

结构：CN(CC(CC=O)c1ccc(F)cc1)C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1

HCID178483575

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4fdddb6937a447d3afc02ad784b34118
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[C:54]([OH:55])([CH3:56])([CH3:57])[CH3:58].[CH3:31][N+:32]1([O-:33])[CH2:34][CH2:36][O:35][CH2:37][CH2:38]1.[CH3:50][C:51](=[O:52])[CH3:53].[F:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([CH2:9][N:10]([C:11]([c:12]2[cH:13][c:14]([C:22]([F:23])([F:24])[F:25])[cH:15][c:16]([C:18]([F:19])([F:20])[F:21])[cH:17]2)=[O:26])[CH3:27])[CH2:28][CH:29]=[CH2:30])[cH:6][cH:7]1.[I+3:44]([O-:45])([O-:46])([O-:47])[O-:48].[Na+:43].[Na+:49].[O:60]=[Os:61](=[O:62])(=[O:63])=[O:64].[OH2:59].[S:39](=[O:40])([OH:41])[O-:42]>>[F:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([CH2:9][N:10]([C:11]([c:12]2[cH:13][c:14]([C:22]([F:23])([F:24])[F:25])[cH:15][c:16]([C:18]([F:19])([F:20])[F:21])[cH:17]2)=[O:26])[CH3:27])[CH2:28][CH:29]=[O:35])[cH:6][cH:7]1