HRID141417

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID11776

Triphenylphosphine

C18H15P

HCID75555

未命名化合物

HCID344290

4-Hydroxy-1-naphthaldehyde

C11H8O2

HCID10588172

2-{5-Methyl-2-[4-(trifluoromethyl)phenyl]-1,3-oxazol-4-yl}ethan-1-ol

C13H12F3NO2

PRODUCTS

生成物

结构：Cc1oc(-c2ccc(C(F)(F)F)cc2)nc1CCOc1ccc(C=O)c2ccccc12

HCID18003552

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-97ba8d47d89e473083efa381539aeaf3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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