HRID152702

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID180

Acetone

C3H6O

HCID813

Potassium cation

K+

2 次

HCID19660

Carbonate

CO3-2

HCID80366

2,2,2-Trifluoroethyl triflate

C3H2F6O3S

HCID5360545

Sodium

反应SMILES：Cc1nc(N2CCC(c3ccc(F)cc3)CC2)c([N+](=O)[O-])c(=O)[nH]1

HCID135617194

未命名化合物

PRODUCTS

产物

反应SMILES：Cc1nc(OCC(F)(F)F)c([N+](=O)[O-])c(N2CCC(c3ccc(F)cc3)CC2)n1

HCID18753287

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-a3d8436c21cd46acaaac310d944c9622
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

[C:39](=[O:40])([O-:41])[O-:42].[CH3:45][C:46](=[O:47])[CH3:48].[F:1][c:2]1[cH:3][cH:4][c:5]([CH:8]2[CH2:9][CH2:10][N:11]([c:14]3[c:15]([N+:22](=[O:23])[O-:24])[c:16](=[O:21])[nH:17][c:18]([CH3:20])[n:19]3)[CH2:12][CH2:13]2)[cH:6][cH:7]1.[F:25][C:26]([F:27])([F:28])[S:29]([O:30][CH2:31][C:32]([F:33])([F:34])[F:35])(=[O:36])=[O:37].[K+:43].[K+:44].[Na:38]>>[F:1][c:2]1[cH:3][cH:4][c:5]([CH:8]2[CH2:9][CH2:10][N:11]([c:14]3[c:15]([N+:22](=[O:23])[O-:24])[c:16]([O:21][CH2:31][C:32]([F:33])([F:34])[F:35])[n:17][c:18]([CH3:20])[n:19]3)[CH2:12][CH2:13]2)[cH:6][cH:7]1