HRID953526

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID8857

Ethyl acetate

C4H8O2

HCID13929055

Methyl 5-hydroxy-2-methylbenzoate

C9H10O3

结构：CS(=O)(=O)c1nc2cc(-c3ccc(-c4ccccc4)cc3)c(F)cc2[nH]1

HCID67445536

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1cc(Oc2nc3cc(-c4ccc(-c5ccccc5)cc4)c(F)cc3[nH]2)ccc1C

HCID68524460

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-17653ea1932249ad8922849736f69405
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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