HRID92206

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6328

Methyl iodide

CH3I

HCID166653

Hydride

H-

结构：O=C(NC1CCC(OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1c1ccccc1)OCc1ccccc1

HCID75024243

未命名化合物

PRODUCTS

生成物

结构：CN(C(=O)OCc1ccccc1)C1CCC(OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1c1ccccc1

HCID86584872

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c1f8c0655dfb49b39d555921b3a35a3c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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