HRID122164

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID19660

Carbonate

CO3-2

HCID31275

1,4-Dioxane

C4H8O2

HCID70942

3,3-Dimethylpiperidine

C7H15N

HCID104967

Cesium(1+)

Cs+

2 次

结构：CC1C(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)OC(=O)N1Cc1cc(C(F)(F)F)ccc1I

HCID76024859

未命名化合物

PRODUCTS

生成物

结构：CC1C(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)OC(=O)N1Cc1cc(C(F)(F)F)ccc1N1CCCC(C)(C)C1

HCID178422028

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-79d4d079ba994ca890078bd39e02aa7f
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

[C:42](=[O:43])([O-:44])[O-:45].[CH2:48]1[O:49][CH2:50][CH2:51][O:52][CH2:53]1.[CH3:34][C:35]1([CH3:41])[CH2:36][NH:37][CH2:38][CH2:39][CH2:40]1.[Cs+:46].[Cs+:47].[F:1][C:2]([c:3]1[cH:4][c:5]([CH:13]2[CH:14]([CH3:31])[N:15]([CH2:19][c:20]3[c:21]([I:30])[cH:22][cH:23][c:24]([C:26]([F:27])([F:28])[F:29])[cH:25]3)[C:16](=[O:18])[O:17]2)[cH:6][c:7]([C:9]([F:10])([F:11])[F:12])[cH:8]1)([F:32])[F:33]>>[F:1][C:2]([c:3]1[cH:4][c:5]([CH:13]2[CH:14]([CH3:31])[N:15]([CH2:19][c:20]3[c:21]([N:37]4[CH2:36][C:35]([CH3:34])([CH3:41])[CH2:40][CH2:39][CH2:38]4)[cH:22][cH:23][c:24]([C:26]([F:27])([F:28])[F:29])[cH:25]3)[C:16](=[O:18])[O:17]2)[cH:6][c:7]([C:9]([F:10])([F:11])[F:12])[cH:8]1)([F:32])[F:33]