HRID194480

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8028

Tetrahydrofuran

C4H8O

2 次

HCID166653

Hydride

H-

HCID4198849

tert-Butyl (2-oxopyrrolidin-3-yl)carbamate

C9H16N2O3

HCID18176315

7-(Bromomethyl)-1-chloro-6-methoxyisoquinoline

C11H9BrClNO

PRODUCTS

生成物

结构：COc1cc2ccnc(Cl)c2cc1CN1CCC(NC(=O)OC(C)(C)C)C1=O

HCID178486655

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-278f7606222441cfb1f150e6a9c9a9a0
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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