HRID826877

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID81531

Diisopropylethylamine

C8H19N

HCID2734688

Benzenacetyl chloride, 4-methoxy-

C9H9ClO2

结构：CC(C)(C)OC(=O)N1CCC(NCc2cccc(Br)c2)CC1

HCID11617611

tert-Butyl 4-{[(3-bromophenyl)methyl]amino}piperidine-1-carboxylate

C17H25BrN2O2

PRODUCTS

生成物

结构：COc1ccc(CC(=O)N(Cc2cccc(Br)c2)C2CCN(C(=O)OC(C)(C)C)CC2)cc1

HCID22643473

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d67b32ec769c4d44ab6d9dc175dbe44b
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[Br:1][c:2]1[cH:3][c:4]([CH2:8][NH:9][CH:10]2[CH2:11][CH2:12][N:13]([C:16](=[O:17])[O:18][C:19]([CH3:20])([CH3:21])[CH3:22])[CH2:14][CH2:15]2)[cH:5][cH:6][cH:7]1.[CH3:32][O:33][c:34]1[cH:35][cH:36][c:37]([CH2:40][C:41](=[O:42])[Cl:43])[cH:38][cH:39]1.[CH:23]([N:24]([CH:25]([CH3:26])[CH3:27])[CH2:28][CH3:29])([CH3:30])[CH3:31].[Cl:45][CH2:46][Cl:47].[OH2:44]>>[Br:1][c:2]1[cH:3][c:4]([CH2:8][N:9]([CH:10]2[CH2:11][CH2:12][N:13]([C:16](=[O:17])[O:18][C:19]([CH3:20])([CH3:21])[CH3:22])[CH2:14][CH2:15]2)[C:41]([CH2:40][c:37]2[cH:36][cH:35][c:34]([O:33][CH3:32])[cH:39][cH:38]2)=[O:42])[cH:5][cH:6][cH:7]1