HRID694631

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID608315

4-Bromo-2-methylanisole

C8H9BrO

HCID2737393

1-(3-cyclohexylpropyl)piperazine

C13H26N2

HCID10913524

1-Benzyloxy-4-bromo-2-chlorobenzene

C13H10BrClO

PRODUCTS

生成物

结构：Clc1cc(N2CCN(CCCC3CCCCC3)CC2)ccc1OCc1ccccc1

HCID23111408

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f33c06e62e734661bccae302f4545299
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

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.[CH2:11]([c:12]1[cH:13][cH:14][cH:15][cH:16][cH:17]1)[O:18][c:19]1[c:20]([Cl:26])[cH:21][c:22]([Br:25])[cH:23][cH:24]1.[CH:27]1([CH2:33][CH2:34][CH2:35][N:36]2[CH2:37][CH2:38][NH:39][CH2:40][CH2:41]2)[CH2:28][CH2:29][CH2:30][CH2:31][CH2:32]1>>[CH2:11]([c:12]1[cH:13][cH:14][cH:15][cH:16][cH:17]1)[O:18][c:19]1[c:20]([Cl:26])[cH:21][c:22]([N:39]2[CH2:38][CH2:37][N:36]([CH2:35][CH2:34][CH2:33][CH:27]3[CH2:28][CH2:29][CH2:30][CH2:31][CH2:32]3)[CH2:41][CH2:40]2)[cH:23][cH:24]1