HRID1219805

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1491502

1-Boc-4-AP

C16H24N2O2

HCID12019237

4-chloromethyl-2-(3,4,5-trimethoxyphenyl) pyridine

C15H16ClNO3

PRODUCTS

生成物

结构：COc1cc(-c2cc(CN(c3ccccc3)C3CCN(C(=O)OC(C)(C)C)CC3)ccn2)cc(OC)c1OC

HCID22557812

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-32f9e3f0c00245eaa29610c1a3f8819f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[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.[Cl:21][CH2:22][c:23]1[cH:24][c:25](-[c:29]2[cH:30][c:31]([O:39][CH3:40])[c:32]([O:37][CH3:38])[c:33]([O:35][CH3:36])[cH:34]2)[n:26][cH:27][cH:28]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[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)[CH2:22][c:23]2[cH:24][c:25](-[c:29]3[cH:30][c:31]([O:39][CH3:40])[c:32]([O:37][CH3:38])[c:33]([O:35][CH3:36])[cH:34]3)[n:26][cH:27][cH:28]2)[CH2:12][CH2:13]1