HRID1566360

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID78607

1,4′-Bipiperidine

C10H20N2

HCID81531

Diisopropylethylamine

C8H19N

结构：COC(=O)c1c(CBr)c(-c2ccccc2)nc2ccccc12

HCID10498448

4-Quinolinecarboxylic acid, 3-(bromomethyl)-2-phenyl-, methyl ester

C18H14BrNO2

PRODUCTS

生成物

结构：COC(=O)c1c(CN2CCC(N3CCCCC3)CC2)c(-c2ccccc2)nc2ccccc12

HCID10813149

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-41c64bd9680542c7a70043efc607a986
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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