HRID102300

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID79214

1-Phenethylpiperazine

C12H18N2

HCID608315

4-Bromo-2-methylanisole

C8H9BrO

HCID2724983

4-Bromo-2,5-difluoroanisole

C7H5BrF2O

HCID23111496

未命名化合物

PRODUCTS

生成物

结构：COc1cc(F)c(N2CCC(CCCC3CCCCC3)CC2)cc1F

HCID23111463

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b5a506ced4dc4e149b3e6ab266d8e9b1
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[Br:1][c:2]1[cH:3][cH:4][c:5]([O:6][CH3:7])[c:8]([CH3:9])[cH:10]1.[Br:25][c:26]1[cH:27][c:28]([F:35])[c:29]([O:33][CH3:34])[cH:30][c:31]1[F:32].[CH2:11]([N:12]1[CH2:13][CH2:14][NH:15][CH2:16][CH2:17]1)[CH2:18][c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1.[CH:36]1([CH2:42][CH2:43][CH2:44][CH:45]2[CH2:46][CH2:47][NH:48][CH2:49][CH2:50]2)[CH2:37][CH2:38][CH2:39][CH2:40][CH2:41]1>>[c:26]1([N:48]2[CH2:47][CH2:46][CH:45]([CH2:44][CH2:43][CH2:42][CH:36]3[CH2:37][CH2:38][CH2:39][CH2:40][CH2:41]3)[CH2:50][CH2:49]2)[cH:27][c:28]([F:35])[c:29]([O:33][CH3:34])[cH:30][c:31]1[F:32]