HRID196464

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+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID166653

Hydride

H-

HCID9974426

Tert-butyl 4-(2-iodoethyl)piperidine-1-carboxylate

C12H22INO2

HCID21898023

未命名化合物

PRODUCTS

生成物

结构：CCC(COCCC1CCN(C(=O)OC(C)(C)C)CC1)n1cnc2cnc3ccccc3c21

HCID21898028

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fece82ebd46a4993858170eba79c44b4
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

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