HRID2148019

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID93218

2-Hydroxy-2-(3-phenoxyphenyl)acetonitrile

C14H11NO2

HCID13118567

未命名化合物

PRODUCTS

生成物

结构：CC(C)C(C(=O)OC(C#N)c1cccc(Oc2ccccc2)c1)c1ccc(OC(F)F)cc1

HCID50980

Flucythrinate

C26H23F2NO4

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b731964747c54b97917de1c1c2b25dee
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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