HRID182651

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8058

n-Hexane

C6H14

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID82544

2-Chloro-5-nitropyrimidine

C4H2ClN3O2

HCID104967

Cesium(1+)

Cs+

2 次

HCID178490909

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(Cn2nc(C)c3c(Oc4ncc([N+](=O)[O-])cn4)ccnc32)cc1

HCID68513917

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b0ad27799b614397bf084ce8f310cacb
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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