HRID189970

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID3776

Isopropanol

C3H8O

HCID28486

Lithium ion

Li+

HCID595203

3,3-dimethyl-3,4-dihydroquinoxalin-2(1H)-one

C10H12N2O

HCID3260420

未命名化合物

HCID22912818

未命名化合物

HCID22912892

6-Fluoro-3,4-dihydro-3,3-dimethyl-2(1H)-quinoxalinone

C10H11FN2O

PRODUCTS

生成物

HCID22912845

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6d0c2aada9ee414d91b7918809df3bfb
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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