HRID2137896

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#N)cc2c1CCCC2)c1ccc(F)cc1

HCID69632158

未命名化合物

PRODUCTS

生成物

结构：CN(CC(CC=O)c1ccc(F)cc1)C(=O)c1cc(C#N)cc2c1CCCC2

HCID72802452

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7bb5ce0a8ffe495bbaad1a28dcb7e226
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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