HRID191753

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID9559

Tetrapropylammonium

C12H28N+

2 次

HCID82029

4-Methylmorpholine 4-oxide

C5H11NO2

反应SMILES：CC(C)Oc1c(C(C)O)cc2c(c1Cl)OC(C)(C)C=C2C(C)C

HCID22491042

未命名化合物

HCID178527104

未命名化合物

PRODUCTS

产物

反应SMILES：CC(=O)c1cc2c(c(Cl)c1OC(C)C)OC(C)(C)C=C2C(C)C

HCID22490893

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-597d6bb319fb4f92822c0f82c1d69226
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应SMILES

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