HRID159436

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

3 次

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

结构：O=[N+]([O-])c1cccc(S(=O)(=O)OCC2CO2)c1

HCID286836

未命名化合物

HCID590225

4-Hydroxy-2-methylindole

C9H9NO

HCID3280088

未命名化合物

PRODUCTS

生成物

HCID12713822

2-Methyl-4-[(oxiran-2-yl)methoxy]-1H-indole

C12H13NO2

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fae4d722e2d946918da589fedf80c6fa
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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