HRID2328478

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID12679

Hexamethylphosphoramide

C6H18N3OP

HCID69321

.alpha.-Nitrotoluene

C7H7NO2

HCID57850131

1,1-Dimethylethyl 2-(2-bromoethyl)-1-pyrrolidinecarboxylate

C11H20BrNO2

HCID178418339

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCCC1CCC(c1ccccc1)[N+](=O)[O-]

HCID58567897

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a12416cd15584f01a930e846a22b740a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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