HRID159481

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

HCID8071

未命名化合物

HCID8857

Ethyl acetate

C4H8O2

HCID2756058

Tert-butyl 1,4-diazepane-1-carboxylate

C10H20N2O2

HCID4574913

未命名化合物

HCID21865555

8-Bromo-6-(propan-2-yl)quinoline

C12H12BrN

PRODUCTS

生成物

结构：CC(C)c1cc(N2CCCN(C(=O)OC(C)(C)C)CC2)c2ncccc2c1

HCID59366163

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e0682c1ba8884837810cb2651d5c1bb6
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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