HRID91525

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID241

Benzene

C6H6

HCID11776

Triphenylphosphine

C18H15P

HCID75555

未命名化合物

HCID10850745

[3-(2,6-Dichlorophenyl)-5-(propan-2-yl)-1,2-oxazol-4-yl]methanol

C13H13Cl2NO2

HCID67297146

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1ccc(Oc2ncc(OCc3c(-c4c(Cl)cccc4Cl)noc3C(C)C)cc2C)cc1

HCID67297286

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-bc3900abad78400f8b834430956b079c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[Cl:20][c:21]1[c:22](-[c:28]2[n:29][o:30][c:31]([CH:35]([CH3:36])[CH3:37])[c:32]2[CH2:33][OH:34])[c:23]([Cl:27])[cH:24][cH:25][cH:26]1.[O:57]=[C:58]([O:59][CH:60]([CH3:61])[CH3:62])[N:63]=[N:64][C:65]([O:66][CH:67]([CH3:68])[CH3:69])=[O:70].[OH:1][c:2]1[cH:3][c:4]([CH3:19])[c:5]([O:8][c:9]2[cH:10][cH:11][c:12]([C:13](=[O:14])[O:15][CH3:16])[cH:17][cH:18]2)[n:6][cH:7]1.[c:38]1([P:39]([c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[c:46]2[cH:47][cH:48][cH:49][cH:50][cH:51]2)[cH:52][cH:53][cH:54][cH:55][cH:56]1.[cH:71]1[cH:72][cH:73][cH:74][cH:75][cH:76]1>>[O:1]([c:2]1[cH:3][c:4]([CH3:19])[c:5]([O:8][c:9]2[cH:10][cH:11][c:12]([C:13](=[O:14])[O:15][CH3:16])[cH:17][cH:18]2)[n:6][cH:7]1)[CH2:33][c:32]1[c:28](-[c:22]2[c:21]([Cl:20])[cH:26][cH:25][cH:24][c:23]2[Cl:27])[n:29][o:30][c:31]1[CH:35]([CH3:36])[CH3:37]