HRID305624

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8140

1-Bromooctane

C8H17Br

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID11687740

tert-Butyl 4-(4-hydroxyphenyl)piperazine-1-carboxylate

C15H22N2O3

PRODUCTS

生成物

结构：CCCCCCCCOc1ccc(N2CCN(C(=O)OC(C)(C)C)CC2)cc1

HCID21182449

1,1-Dimethylethyl 4-[4-(octyloxy)phenyl]-1-piperazinecarboxylate

C23H38N2O3

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-18d19f9447f04ef3a38bff3635c69433
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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