HRID934062

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID241

Benzene

C6H6

HCID4610

1,2-Cyclohexanediamine

C6H14N2

HCID19660

Carbonate

CO3-2

HCID31275

1,4-Dioxane

C4H8O2

HCID95417

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

C17H14O

HCID104815

Cuprous ion

Cu+

HCID104967

Cesium(1+)

Cs+

2 次

HCID1480785

1-(4-fluorophenyl)imidazolidin-2-one

C9H9FN2O

HCID2758875

Trifluoromethanesulfonate

CF3O3S-

结构：CC(C)(C)OC(=O)N1C(C=Cc2ccc(I)cc2)COC1(C)C

HCID67151624

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1C(C=Cc2ccc(N3CCN(c4ccc(F)cc4)C3=O)cc2)COC1(C)C

HCID67151535

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-18a92cf185b7482b882d6060c945f10b
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[C:9]([CH3:22])([CH3:23])[O:10][CH2:11][CH:12]1[CH:13]=[CH:14][c:15]1[cH:16][cH:17][c:18]([I:21])[cH:19][cH:20]1.[C:37](=[O:38])([O-:39])[O-:40].[CH:51](=[CH:52][C:53]([CH:54]=[CH:55][c:56]1[cH:57][cH:58][cH:59][cH:60][cH:61]1)=[O:62])[c:63]1[cH:64][cH:65][cH:66][cH:67][cH:68]1.[Cs+:41].[Cs+:42].[Cu+:89].[F:24][c:25]1[cH:26][cH:27][c:28]([N:31]2[C:32](=[O:36])[NH:33][CH2:34][CH2:35]2)[cH:29][cH:30]1.[NH2:43][CH:44]1[CH2:45][CH2:46][CH2:47][CH2:48][CH:49]1[NH2:50].[O:69]1[CH2:70][CH2:71][O:72][CH2:73][CH2:74]1.[S:81]([O-:82])([C:83]([F:84])([F:85])[F:86])(=[O:87])=[O:88].[cH:75]1[cH:76][cH:77][cH:78][cH:79][cH:80]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[C:9]([CH3:22])([CH3:23])[O:10][CH2:11][CH:12]1[CH:13]=[CH:14][c:15]1[cH:16][cH:17][c:18]([N:33]2[C:32](=[O:36])[N:31]([c:28]3[cH:27][cH:26][c:25]([F:24])[cH:30][cH:29]3)[CH2:35][CH2:34]2)[cH:19][cH:20]1