HRID1144182

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6228

Dimethylformamide

C3H7NO

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID76300

Ethyl 4-bromobutyrate

C6H11BrO2

反应SMILES：CCCCN(CC)c1ccc(C(F)(F)F)cc1CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ncc(O)cn1

HCID86626755

未命名化合物

PRODUCTS

产物

反应SMILES：CCCCN(CC)c1ccc(C(F)(F)F)cc1CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ncc(OCCCC(=O)OCC)cn1

HCID86626756

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-293ed787c0464c9c94d77e11c4aecf5d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应SMILES

[Br:42][CH2:43][CH2:44][CH2:45][C:46](=[O:47])[O:48][CH2:49][CH3:50].[C:51](=[O:52])([O-:53])[O-:54].[CH3:57][CH2:58][O:59][C:60](=[O:61])[CH3:62].[CH3:63][N:64]([CH3:65])[CH:66]=[O:67].[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:6][N:7]([c:8]2[n:9][cH:10][c:11]([OH:14])[cH:12][n:13]2)[CH2:15][c:16]2[c:17]([N:26]([CH2:27][CH3:28])[CH2:29][CH2:30][CH2:31][CH3:32])[cH:18][cH:19][c:20]([C:22]([F:23])([F:24])[F:25])[cH:21]2)[cH:33][c:34]([C:36]([F:37])([F:38])[F:39])[cH:35]1)([F:40])[F:41].[K+:55].[K+:56]>>[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:6][N:7]([c:8]2[n:9][cH:10][c:11]([O:14][CH2:43][CH2:44][CH2:45][C:46](=[O:47])[O:48][CH2:49][CH3:50])[cH:12][n:13]2)[CH2:15][c:16]2[c:17]([N:26]([CH2:27][CH3:28])[CH2:29][CH2:30][CH2:31][CH3:32])[cH:18][cH:19][c:20]([C:22]([F:23])([F:24])[F:25])[cH:21]2)[cH:33][c:34]([C:36]([F:37])([F:38])[F:39])[cH:35]1)([F:40])[F:41]