HRID669595

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID19660

Carbonate

CO3-2

HCID346961

Methyl 6-chloro-5-nitronicotinate

C7H5ClN2O4

HCID21671901

tert-Butyl (pyrrolidin-2-yl)acetate

C10H19NO2

PRODUCTS

生成物

结构：COC(=O)c1cnc(N2CCCC2CC(=O)OC(C)(C)C)c([N+](=O)[O-])c1

HCID58324476

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-593a766f7bc04a7189c6fc5a4a75e6b8
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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