HRID118185

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

HCID19660

Carbonate

CO3-2

HCID67709

1,1,1-Trifluoro-2-iodoethane

C2H2F3I

结构：CC(C)(C)OC(=O)N1CCC(=Cc2cccc(Oc3ccc(O)cc3)c2)CC1

HCID66876036

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCC(=Cc2cccc(Oc3ccc(OCC(F)(F)F)cc3)c2)CC1

HCID66876113

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-46039d6e02284499916afcb9d22c6670
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:29](=[O:30])([O-:31])[O-:32].[CH3:41][N:42]([CH3:43])[CH:44]=[O:45].[I:35][CH2:36][C:37]([F:38])([F:39])[F:40].[K+:33].[K+:34].[OH:1][c:2]1[cH:3][cH:4][c:5]([O:6][c:7]2[cH:8][c:9]([CH:10]=[C:11]3[CH2:12][CH2:13][N:14]([C:17](=[O:18])[O:19][C:20]([CH3:21])([CH3:22])[CH3:23])[CH2:15][CH2:16]3)[cH:24][cH:25][cH:26]2)[cH:27][cH:28]1>>[O:1]([c:2]1[cH:3][cH:4][c:5]([O:6][c:7]2[cH:8][c:9]([CH:10]=[C:11]3[CH2:12][CH2:13][N:14]([C:17](=[O:18])[O:19][C:20]([CH3:21])([CH3:22])[CH3:23])[CH2:15][CH2:16]3)[cH:24][cH:25][cH:26]2)[cH:27][cH:28]1)[CH2:36][C:37]([F:38])([F:39])[F:40]