HRID806352

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID311

Citric acid

C6H8O7

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID11011

Trichloroacetonitrile

C2Cl3N

HCID11776

Triphenylphosphine

C18H15P

HCID70272

4-Chloro-N-methylaniline

C7H8ClN

结构：CC(C)(C)OC(=O)NC12CCC(C(=O)O)(CC1)CC2

HCID23150738

4-[(tert-Butoxycarbonyl)amino]bicyclo[2.2.2]octane-1-carboxylic acid

C14H23NO4

PRODUCTS

生成物

结构：CN(C(=O)C12CCC(NC(=O)OC(C)(C)C)(CC1)CC2)c1ccc(Cl)cc1

HCID23150517

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-22052b06dc7b48f9a6f5e9071258a703
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

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][C:9]12[CH2:10][CH2:11][C:12]([C:17](=[O:18])[OH:19])([CH2:13][CH2:14]1)[CH2:15][CH2:16]2.[CH3:70][CH2:71][N:72]([CH2:73][CH3:74])[CH2:75][CH3:76].[Cl:20][C:21]([Cl:22])([Cl:23])[C:24]#[N:25].[Cl:45][c:46]1[cH:47][cH:48][c:49]([NH:50][CH3:51])[cH:52][cH:53]1.[Cl:67][CH2:68][Cl:69].[OH:54][C:55]([CH2:56][C:57]([C:58](=[O:59])[OH:60])([CH2:61][C:62](=[O:63])[OH:64])[OH:65])=[O:66].[c:26]1([P:27]([c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[cH:40][cH:41][cH:42][cH:43][cH:44]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][C:9]12[CH2:10][CH2:11][C:12]([C:17](=[O:19])[N:50]([c:49]3[cH:48][cH:47][c:46]([Cl:45])[cH:53][cH:52]3)[CH3:51])([CH2:13][CH2:14]1)[CH2:15][CH2:16]2