HRID662456

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID923

Sodium ion

Na+

HCID6115

Aniline

C6H7N

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID8028

Tetrahydrofuran

C4H8O

HCID65578

Ethanedioyl dichloride

C2Cl2O2

HCID166653

Hydride

H-

HCID2735647

1-(tert-Butoxycarbonyl)piperidine-3-carboxylic acid

C11H19NO4

HCID178418339

Butyllithium

C4H9Li

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCCC(C(=O)Nc2ccccc2)C1

HCID18104216

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-17a0a91c106441fea893f2ae7b06b040
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([C:14](=[O:15])[OH:16])[CH2:11][CH2:12][CH2:13]1.[CH2:32]([Li:33])[CH2:34][CH2:35][CH3:36].[CH3:47][N:48]([CH3:49])[CH:50]=[O:51].[Cl-:37].[Cl:19][C:20]([C:21]([Cl:22])=[O:23])=[O:24].[Cl:39][CH2:40][Cl:41].[H-:17].[NH2:25][c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1.[NH4+:38].[Na+:18].[O:42]1[CH2:43][CH2:44][CH2:45][CH2:46]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([C:14](=[O:16])[NH:25][c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[CH2:11][CH2:12][CH2:13]1