HRID670460

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID19660

Carbonate

CO3-2

HCID104967

Cesium(1+)

Cs+

2 次

HCID53378235

未命名化合物

HCID67249455

未命名化合物

PRODUCTS

生成物

结构：CC(C)Oc1ccc(COc2ccc3c(c2)cc2n3CCC2CC(=O)OC(C)(C)C)cc1C(F)(F)F

HCID67248886

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-144806c4b04a44cc8106d76c09f242e2
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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