HRID2151918

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID7294

Methyl acrylate

C4H6O2

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

结构：CC(C)(Cc1c[nH]c2c(OS(=O)(=O)C(F)(F)F)cccc12)NC(=O)OC(C)(C)C

HCID86595245

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C=Cc1cccc2c(CC(C)(C)NC(=O)OC(C)(C)C)c[nH]c12

HCID69517846

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c75ca1b760174b50aaa9f687440d8820
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:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][C:9]([CH2:10][c:11]1[cH:12][nH:13][c:14]2[c:15]([O:20][S:21]([C:22]([F:23])([F:24])[F:25])(=[O:26])=[O:27])[cH:16][cH:17][cH:18][c:19]12)([CH3:28])[CH3:29].[C:30]([CH:31]=[CH2:32])(=[O:33])[O:34][CH3:35].[CH3:36][CH2:37][N:38]([CH2:39][CH3:40])[CH2:41][CH3:42].[CH3:43][CH2:44][O:45][C:46](=[O:47])[CH3:48].[CH3:49][N:50]([CH3:51])[CH:52]=[O:53]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][C:9]([CH2:10][c:11]1[cH:12][nH:13][c:14]2[c:15]([CH:32]=[CH:31][C:30](=[O:33])[O:34][CH3:35])[cH:16][cH:17][cH:18][c:19]12)([CH3:28])[CH3:29]