HRID1237660

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID1140

Toluene

C7H8

结构：COC(=O)C=P(c1ccccc1)(c1ccccc1)c1ccccc1

HCID17453

Methyl (triphenylphosphoranylidene)acetate

C21H19O2P

HCID22663424

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C=Cc1ccc2c(C)cn(CCCc3ccccc3)c2c1

HCID54159080

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fad64581dd1040598876f57d50a46094
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[C:22](=[O:23])([O:24][CH3:25])[CH:26]=[P:27]([c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1)([c:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1)[c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1.[CH3:1][c:2]1[cH:3][n:4]([CH2:13][CH2:14][CH2:15][c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[c:5]2[cH:6][c:7]([CH:11]=[O:12])[cH:8][cH:9][c:10]12.[CH3:47][c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1.[OH2:46]>>[CH3:1][c:2]1[cH:3][n:4]([CH2:13][CH2:14][CH2:15][c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[c:5]2[cH:6][c:7]([CH:47]=[CH:26][C:22](=[O:23])[O:24][CH3:25])[cH:8][cH:9][c:10]12