HRID821128

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID241

Benzene

C6H6

HCID16278

N,N-Dimethylacetoacetamide

C6H11NO2

结构：C#CCC(NC(=O)C12CC3CC(C1)CC(C(=O)OC)(C3)C2)C(=O)OC(C)(C)C

HCID21940505

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C12CC3CC(CC(C(=O)NC(CC#CCC(=O)N(C)C)C(=O)OC(C)(C)C)(C3)C1)C2

HCID21940554

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d4320eef30594b3e90698a7d5e9d86e0
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:29]([CH2:30][C:31]([CH3:32])=[O:33])(=[O:34])[N:35]([CH3:36])[CH3:37].[CH3:1][O:2][C:3](=[O:4])[C:5]12[CH2:6][C:7]3([C:15](=[O:16])[NH:17][CH:18]([C:19](=[O:20])[O:21][C:22]([CH3:23])([CH3:24])[CH3:25])[CH2:26][C:27]#[CH:28])[CH2:8][CH:9]([CH2:10][CH:11]([CH2:12]1)[CH2:13]3)[CH2:14]2.[cH:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1>>[CH3:1][O:2][C:3](=[O:4])[C:5]12[CH2:6][C:7]3([C:15](=[O:16])[NH:17][CH:18]([C:19](=[O:20])[O:21][C:22]([CH3:23])([CH3:24])[CH3:25])[CH2:26][C:27]#[C:28][CH2:30][C:29](=[O:34])[N:35]([CH3:36])[CH3:37])[CH2:8][CH:9]([CH2:10][CH:11]([CH2:12]1)[CH2:13]3)[CH2:14]2