HRID1551074

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

HCID19660

Carbonate

CO3-2

HCID24813

Phosphoric trichloride

Cl3OP

HCID30165

Iodide ion

I-

HCID81747

3,5-Dimethoxybenzaldehyde

C9H10O3

HCID104967

Cesium(1+)

Cs+

2 次

HCID21974252

4-(Chloromethyl)-2-(3,5-dimethoxyphenyl)-5-methyl-1,3-oxazole

C13H14ClNO3

HCID69280481

未命名化合物

PRODUCTS

生成物

结构：CCOC(Cc1ccc(OCc2nc(-c3cc(OC)cc(OC)c3)oc2C)cc1C)C(=O)OC

HCID69280727

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c2cb054056bc4a888c849fd3e44621c9
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:53](=[O:54])([O-:55])[O-:56].[CH3:1][O:2][C:3]([CH:4]([CH2:5][c:6]1[c:7]([CH3:13])[cH:8][c:9]([OH:12])[cH:10][cH:11]1)[O:14][CH2:15][CH3:16])=[O:17].[CH3:36][O:37][c:38]1[cH:39][c:40]([CH:46]=[O:47])[cH:41][c:42]([O:43][CH3:44])[cH:45]1.[Cl:18][CH2:19][c:20]1[n:21][c:22](-[c:26]2[cH:27][c:28]([O:34][CH3:35])[cH:29][c:30]([O:32][CH3:33])[cH:31]2)[o:23][c:24]1[CH3:25].[Cs+:57].[Cs+:58].[I-:60].[K+:59].[P:48]([Cl:49])([Cl:50])([Cl:51])=[O:52]>>[CH3:1][O:2][C:3]([CH:4]([CH2:5][c:6]1[c:7]([CH3:13])[cH:8][c:9]([O:12][CH2:19][c:20]2[n:21][c:22](-[c:26]3[cH:27][c:28]([O:34][CH3:35])[cH:29][c:30]([O:32][CH3:33])[cH:31]3)[o:23][c:24]2[CH3:25])[cH:10][cH:11]1)[O:14][CH2:15][CH3:16])=[O:17]