HRID183433

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID10491565

1-[2-(2,2,2-Trifluoroethoxy)phenyl]piperazine

C12H15F3N2O

HCID15840667

未命名化合物

PRODUCTS

生成物

HCID313

Hydrochloric Acid

ClH

结构：Cc1cn(CCCN2CCN(c3ccccc3OCC(F)(F)F)CC2)c(=O)n(Cc2ccccc2)c1=O

HCID70201863

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ef87450a501c45168ce4cb46e12c44fc
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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