HRID295651

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID1140

Toluene

C7H8

HCID16028

Tetrabutylammonium

C16H36N+

HCID19660

Carbonate

CO3-2

HCID23938

Palladium

2 次

HCID28179

Fluoride

F-

HCID95417

1,5-Diphenyl-1,4-pentadien-3-one

C17H14O

3 次

HCID104967

Cesium(1+)

Cs+

2 次

HCID3857574

Benzenesulfinate

C6H5O2S-

HCID11098384

5-Oxo-5,6,7,8-tetrahydronaphthalen-2-yl trifluoromethanesulfonate

C11H9F3O4S

PRODUCTS

生成物

HCID59021739

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7c27b941ef2a44bf865e7fe257b6b8c4
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[C:30](=[O:31])([O-:32])[O-:33].[CH3:110][c:111]1[cH:112][cH:113][cH:114][cH:115][cH:116]1.[CH3:37][CH2:38][CH2:39][CH2:40][N+:41]([CH2:42][CH2:43][CH2:44][CH3:45])([CH2:46][CH2:47][CH2:48][CH3:49])[CH2:50][CH2:51][CH2:52][CH3:53].[CH:56](=[CH:57][C:58]([CH:59]=[CH:60][c:61]1[cH:62][cH:63][cH:64][cH:65][cH:66]1)=[O:67])[c:68]1[cH:69][cH:70][cH:71][cH:72][cH:73]1.[CH:74](=[CH:75][C:76]([CH:77]=[CH:78][c:79]1[cH:80][cH:81][cH:82][cH:83][cH:84]1)=[O:85])[c:86]1[cH:87][cH:88][cH:89][cH:90][cH:91]1.[CH:92](=[CH:93][C:94]([CH:95]=[CH:96][c:97]1[cH:98][cH:99][cH:100][cH:101][cH:102]1)=[O:103])[c:104]1[cH:105][cH:106][cH:107][cH:108][cH:109]1.[Cs+:34].[Cs+:35].[F-:36].[Na+:29].[O:1]=[C:2]1[c:3]2[cH:4][cH:5][c:6]([O:12][S:13]([C:14]([F:15])([F:16])[F:17])(=[O:18])=[O:19])[cH:7][c:8]2[CH2:9][CH2:10][CH2:11]1.[Pd:54].[Pd:55].[c:20]1([S:26](=[O:27])[O-:28])[cH:21][cH:22][cH:23][cH:24][cH:25]1>>[O:1]=[C:2]1[c:3]2[cH:4][cH:5][c:6]([S:26]([c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)(=[O:27])=[O:28])[cH:7][c:8]2[CH2:9][CH2:10][CH2:11]1