HRID125988

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID180

Acetone

C3H6O

HCID813

Potassium cation

K+

2 次

HCID19660

Carbonate

CO3-2

HCID31374

Dimethylacetamide

C4H9NO

HCID10352036

4-Fluoro-5-hydroxy-2-methylindole

C9H8FNO

结构：COc1cc2c(Cl)ncnc2cc1OCCN1CCN(C(C)=O)CC1

HCID58960240

未命名化合物

PRODUCTS

生成物

结构：COc1cc2c(Oc3ccc4[nH]c(C)cc4c3F)ncnc2cc1OCCN1CCN(C(C)=O)CC1

HCID11752254

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a01219c4d60349a095c91d75af21a031
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

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