HRID321766

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6395

Methanesulfonic acid

CH4O3S

HCID19660

Carbonate

CO3-2

HCID2764081

N-Boc-4-piperidinemethanol

C11H21NO3

结构：COc1cc2c(Oc3ccc([N+](=O)[O-])cc3F)ccnc2cc1O

HCID136175701

未命名化合物

PRODUCTS

生成物

结构：COc1cc2c(Oc3ccc([N+](=O)[O-])cc3F)ccnc2cc1OCC1CCN(C(=O)OC(C)(C)C)CC1

HCID59342475

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-be062dfb0d2b4f7a8ac1dd7055146cfb
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:36](=[O:37])([O:38][C:39]([CH3:40])([CH3:41])[CH3:42])[N:43]1[CH2:44][CH2:45][CH:46]([CH2:49][OH:50])[CH2:47][CH2:48]1.[CH3:31][S:32]([OH:33])(=[O:34])=[O:35].[F:1][c:2]1[c:3]([O:4][c:5]2[cH:6][cH:7][n:8][c:9]3[cH:10][c:11]([OH:17])[c:12]([O:15][CH3:16])[cH:13][c:14]23)[cH:18][cH:19][c:20]([N+:22](=[O:23])[O-:24])[cH:21]1.[K+:25].[K+:26].[O-:27][C:28]([O-:29])=[O:30].[O:51]=[CH:52][N:53]([CH3:54])[CH3:55]>>[F:1][c:2]1[c:3]([O:4][c:5]2[cH:6][cH:7][n:8][c:9]3[cH:10][c:11]([O:17][CH2:49][CH:46]4[CH2:45][CH2:44][N:43]([C:36](=[O:37])[O:38][C:39]([CH3:40])([CH3:41])[CH3:42])[CH2:48][CH2:47]4)[c:12]([O:15][CH3:16])[cH:13][c:14]23)[cH:18][cH:19][c:20]([N+:22](=[O:23])[O-:24])[cH:21]1