HRID1563631

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID75051

(Triphenylphosphoranylidene)acetaldehyde

C20H17OP

结构：CCn1nnc(C(C=O)=C(c2ccc(F)cc2)c2ccc(F)cc2)n1

HCID14723827

未命名化合物

PRODUCTS

生成物

结构：CCn1nnc(C(C=CC=O)=C(c2ccc(F)cc2)c2ccc(F)cc2)n1

HCID54524508

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-73803eb853f54bb288923c4d6c5592e0
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

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