HRID1563277

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7679

Benzeneacetyl chloride

C8H7ClO

结构：CC(C)(C)OC(=O)N1CCC(c2ccc(CN)cc2)C(OCc2ccc3ccccc3c2)C1

HCID53800110

tert-butyl (3RS,4RS)-4-(4-aminomethyl-phenyl)-3-(naphthalen-2-ylmethoxy)-piperidine-1-carboxylate

C28H34N2O3

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCC(c2ccc(CNC(=O)Cc3ccccc3)cc2)C(OCc2ccc3ccccc3c2)C1

HCID54306636

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-31604f9095a4457e81e73463af647ef7
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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