HRID142987

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

3 次

HCID1061

Phosphate

O4P-3

HCID1140

Toluene

C7H8

HCID23938

Palladium

2 次

HCID95417

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

C17H14O

3 次

HCID101254

2-Fluoro-4-nitroaniline

C6H5FN2O2

HCID59424524

未命名化合物

PRODUCTS

产物

HCID59457676

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-55a5e5085de845a2a72f06cb95710a95
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

[CH3:36][c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1.[Cl:1][c:2]1[c:3]2[c:4]([n:5][cH:6][cH:7]1)[cH:8][c:9](-[c:11]1[n:12][cH:13][n:14]([CH3:16])[cH:15]1)[s:10]2.[F:17][c:18]1[c:19]([NH2:20])[cH:21][cH:22][c:23]([N+:25](=[O:26])[O-:27])[cH:24]1.[K+:33].[K+:34].[K+:35].[O:45]=[C:46]([CH:47]=[CH:48][c:49]1[cH:50][cH:51][cH:52][cH:53][cH:54]1)[CH:55]=[CH:56][c:57]1[cH:58][cH:59][cH:60][cH:61][cH:62]1.[O:63]=[C:64]([CH:65]=[CH:66][c:67]1[cH:68][cH:69][cH:70][cH:71][cH:72]1)[CH:73]=[CH:74][c:75]1[cH:76][cH:77][cH:78][cH:79][cH:80]1.[O:81]=[C:82]([CH:83]=[CH:84][c:85]1[cH:86][cH:87][cH:88][cH:89][cH:90]1)[CH:91]=[CH:92][c:93]1[cH:94][cH:95][cH:96][cH:97][cH:98]1.[P:28]([O-:29])([O-:30])([O-:31])=[O:32].[Pd:43].[Pd:44]>>[c:2]1([NH:20][c:19]2[c:18]([F:17])[cH:24][c:23]([N+:25](=[O:26])[O-:27])[cH:22][cH:21]2)[c:3]2[c:4]([n:5][cH:6][cH:7]1)[cH:8][c:9](-[c:11]1[n:12][cH:13][n:14]([CH3:16])[cH:15]1)[s:10]2