HRID116450

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID311

Citric Acid

C6H8O7

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6328

Methyl iodide

CH3I

HCID166653

Hydride

H-

结构：CC1(NC(=O)OC(C)(C)C)CCN(C(=O)OCc2ccccc2)C1

HCID60205236

Benzyl 3-[(tert-butoxycarbonyl)amino]-3-methylpyrrolidine-1-carboxylate

C18H26N2O4

PRODUCTS

生成物

结构：CN(C(=O)OC(C)(C)C)C1(C)CCN(C(=O)OCc2ccccc2)C1

HCID75604942

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a9317410a6064ce6bf0f472fa5de6d35
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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