HRID2141670

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID679

Dimethyl sulfoxide

C2H6OS

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID8471

Triethylamine

C6H15N

HCID19660

Carbonate

CO3-2

HCID143452

tert-Butyl piperazine-1-carboxylate

C9H18N2O2

HCID59849202

未命名化合物

PRODUCTS

生成物

结构：CN1Cc2c(N3CCN(C(=O)OC(C)(C)C)CC3)ccc([N+](=O)[O-])c2C1=O

HCID59849195

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-cc3fb196736440488bc949532a5407b6
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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