HRID2339778

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID74049

1-Methyl-4-piperidone

C6H11NO

反应SMILES：Brc1ccc2c(c1)CN(C(c1ccccc1)(c1ccccc1)c1ccccc1)C2

HCID59263113

未命名化合物

HCID178418339

Butyllithium

C4H9Li

PRODUCTS

产物

反应SMILES：CN1CCC(O)(c2ccc3c(c2)CN(C(c2ccccc2)(c2ccccc2)c2ccccc2)C3)CC1

HCID59263137

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-b45d3de312204c228ed39f96ef4e13e8
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应SMILES

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