HRID819139

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID3283

Diethyl Ether

C4H10O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

HCID123153

Phenol, 2,4,5-trifluoro-

C6H3F3O

结构：CC(C)(C)OC(=O)N1CCC(n2ncc3c(Cl)ncnc32)CC1

HCID57964905

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCC(n2ncc3c(Oc4cc(F)c(F)cc4F)ncnc32)CC1

HCID57964889

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-414bafb58e1640e3bd1965986b58baca
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:1](=[O:2])([O-:3])[O-:4].[C:7]([CH3:8])([CH3:9])([CH3:10])[O:11][C:12](=[O:13])[N:14]1[CH2:15][CH2:16][CH:17]([n:20]2[n:21][cH:22][c:23]3[c:24]2[n:25][cH:26][n:27][c:28]3[Cl:29])[CH2:18][CH2:19]1.[CH3:41][N:42]([CH3:43])[CH:44]=[O:45].[CH3:46][CH2:47][O:48][CH2:49][CH3:50].[F:30][c:31]1[c:32]([OH:39])[cH:33][c:34]([F:38])[c:35]([F:37])[cH:36]1.[K+:5].[K+:6].[OH2:40]>>[C:7]([CH3:8])([CH3:9])([CH3:10])[O:11][C:12](=[O:13])[N:14]1[CH2:15][CH2:16][CH:17]([n:20]2[n:21][cH:22][c:23]3[c:24]2[n:25][cH:26][n:27][c:28]3[O:39][c:32]2[c:31]([F:30])[cH:36][c:35]([F:37])[c:34]([F:38])[cH:33]2)[CH2:18][CH2:19]1