HRID1210749

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID280

Carbon dioxide

CO2

HCID3776

Isopropanol

C3H8O

HCID8028

Tetrahydrofuran

C4H8O

HCID11819850

3-((Benzyloxy)methyl)cyclobutanone

C12H14O2

HCID12738004

1-[(4-Bromophenyl)methyl]pyrrolidine

C11H14BrN

HCID178418339

Butyllithium

C4H9Li

PRODUCTS

生成物

结构：OC1(c2ccc(CN3CCCC3)cc2)CC(COCc2ccccc2)C1

HCID11210325

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e957d9f4eb7f43da8a745aa4b5980ec7
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

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