HRID1114534

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID15917590

2-Phenylethyl carbonochloridate

C9H9ClO2

HCID54269479

未命名化合物

PRODUCTS

生成物

结构：CCCCCCCC(CCC(=O)OCC=C(C)CCC=C(C)C)OC(=O)OCCc1ccccc1

HCID54096758

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4a3c3da6744b4dd3a1baaa2c5383beda
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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