HRID1541116

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID923

Sodium ion

Na+

2 次

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

结构：COc1nccc2nc(-c3ccc(C4OCCO4)cc3)c(-c3ccccc3)cc12

HCID59264620

2-[4-(1,3-Dioxolan-2-yl)phenyl]-5-methoxy-3-phenyl-1,6-naphthyridine

C24H20N2O3

PRODUCTS

生成物

结构：COc1nccc2nc(-c3ccc(C=O)cc3)c(-c3ccccc3)cc12

HCID59846137

4-(5-Methoxy-3-phenyl-1,6-naphthyridin-2-yl)benzaldehyde

C22H16N2O2

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-912f0b250e974208b68c620f42bea488
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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