HRID1116123

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID962

Water

H2O

HCID7914

Isopropyl ether

C6H14O

HCID8471

Triethylamine

C6H15N

HCID70865

4-Anilino-1-benzylpiperidine

C18H22N2

HCID53939189

未命名化合物

PRODUCTS

生成物

结构：CCCCOC=CC(=O)N(c1ccccc1)C1CCN(Cc2ccccc2)CC1

HCID54210636

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-be5408ea5a664bc2961fb34a3eec34b4
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

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH2:10][CH:11]([NH:14][c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[CH2:12][CH2:13]1.[CH2:29]([CH2:30][CH2:31][CH3:32])[O:33][CH:34]=[CH:35][C:36](=[O:37])[OH:38].[CH3:21][CH2:22][N:23]([CH2:24][CH3:25])[CH2:26][CH3:27].[CH:40]([O:41][CH:42]([CH3:43])[CH3:44])([CH3:45])[CH3:46].[Cl-:28].[OH2:39]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH2:10][CH:11]([N:14]([c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[C:36]([CH:35]=[CH:34][O:33][CH2:29][CH2:30][CH2:31][CH3:32])=[O:37])[CH2:12][CH2:13]1