HRID305584

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6373

Trifluoromethane

CHF3

HCID8028

Tetrahydrofuran

C4H8O

HCID16028

Tetrabutylammonium

C16H36N+

HCID19660

Carbonate

CO3-2

HCID28179

Fluoride

F-

HCID70435

Silane, trimethyl-

C3H10Si

HCID104967

Cesium(1+)

Cs+

2 次

结构：O=C(CC1(c2ccccc2C(F)(F)F)CCC1)C(=O)Nc1ccc(-c2ncco2)cc1

HCID58897678

未命名化合物

PRODUCTS

生成物

结构：O=C(Nc1ccc(-c2ncco2)cc1)C(O)(CC1(c2ccccc2C(F)(F)F)CCC1)C(F)(F)F

HCID23641550

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-754404303bcb49a1bc242c5f5784d7ac
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:32](=[O:33])([O-:34])[O-:35].[CH3:42][SiH:43]([CH3:44])[CH3:45].[CH3:47][CH2:48][CH2:49][CH2:50][N+:51]([CH2:52][CH2:53][CH2:54][CH3:55])([CH2:56][CH2:57][CH2:58][CH3:59])[CH2:60][CH2:61][CH2:62][CH3:63].[CH3:64][N:65]([CH3:66])[CH:67]=[O:68].[Cs+:36].[Cs+:37].[F-:46].[F:38][CH:39]([F:40])[F:41].[O:69]1[CH2:70][CH2:71][CH2:72][CH2:73]1.[o:1]1[c:2](-[c:6]2[cH:7][cH:8][c:9]([NH:12][C:13]([C:14]([CH2:15][C:16]3([c:20]4[c:21]([C:26]([F:27])([F:28])[F:29])[cH:22][cH:23][cH:24][cH:25]4)[CH2:17][CH2:18][CH2:19]3)=[O:30])=[O:31])[cH:10][cH:11]2)[n:3][cH:4][cH:5]1>>[o:1]1[c:2](-[c:6]2[cH:7][cH:8][c:9]([NH:12][C:13]([C:14]([CH2:15][C:16]3([c:20]4[c:21]([C:26]([F:27])([F:28])[F:29])[cH:22][cH:23][cH:24][cH:25]4)[CH2:17][CH2:18][CH2:19]3)([OH:30])[C:39]([F:38])([F:40])[F:41])=[O:31])[cH:10][cH:11]2)[n:3][cH:4][cH:5]1