HRID293744

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID166653

Hydride

H-

HCID2760403

2-phenylpropanoyl chloride

C9H9ClO

结构：O=c1cc(O)c2cccnc2n1-c1cccc(C(F)(F)F)c1

HCID58636588

4-Hydroxy-1-[3-(trifluoromethyl)phenyl]-1,8-naphthyridin-2(1H)-one

C15H9F3N2O2

HCID178418361

未命名化合物

PRODUCTS

生成物

结构：CC(C(=O)Oc1cc(=O)n(-c2cccc(C(F)(F)F)c2)c2ncccc12)c1ccccc1

HCID68945365

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c3cd27ed2e1f41cf8b86e8baad079541
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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