HRID2175263

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID85141

3-Bromobenzyl alcohol

C7H7BrO

结构：Cc1cccc(OCCCC(=O)N2CCCc3c(-c4cnn(C(C)(C)CO)c4)cccc32)c1C

HCID70983117

未命名化合物

结构：O=C(OCc1cccc(Br)c1)Oc1ccc([N+](=O)[O-])cc1

HCID86712580

未命名化合物

PRODUCTS

生成物

结构：Cc1cccc(OCCCC(=O)N2CCCc3c(-c4cnn(C(C)(C)COC(=O)Oc5ccc([N+](=O)[O-])cc5)c4)cccc32)c1C

HCID86712588

未命名化合物

PROCEDURE

实验过程

The title compound was prepared using a procedure analogous to 3-bromobenzyl 4-nitrophenyl carbonate except that (3-bromophenyl)methanol was replaced with 4-(2,3-dimethylphenoxy)-1-(5-(1-(1-hydroxy-2-methylpropan-2-yl)-1H-pyrazol-4-yl)-3,4-dihydroquinolin-1(2H)-yl)butan-1-one. LCMS, [M+H]+=627.5.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-08acaf1bb3314c2daf8109629a60ceff
来源数据集: uspto-grants-2015_06
DOI: 10.6084/m9.figshare.5104873.v1
专利: US09062028B2
来源说明: uspto-grants-2015_06

反应 SMILES

[C:1](=[O:21])([O:11][C:12]1[CH:17]=[CH:16][C:15]([N+:18]([O-:20])=[O:19])=[CH:14][CH:13]=1)[O:2][CH2:3][C:4]1[CH:9]=CC=C(Br)[CH:5]=1.BrC1C=C(CO)C=CC=1.[CH3:31][C:32]1[C:63]([CH3:64])=[CH:62][CH:61]=[CH:60][C:33]=1[O:34][CH2:35][CH2:36][CH2:37][C:38]([N:40]1[C:49]2[C:44](=[C:45]([C:50]3[CH:51]=[N:52][N:53](C(C)(C)CO)[CH:54]=3)[CH:46]=[CH:47][CH:48]=2)[CH2:43][CH2:42][CH2:41]1)=[O:39]>>[C:1](=[O:21])([O:11][C:12]1[CH:13]=[CH:14][C:15]([N+:18]([O-:20])=[O:19])=[CH:16][CH:17]=1)[O:2][CH2:3][C:4]([N:52]1[CH:51]=[C:50]([C:45]2[CH:46]=[CH:47][CH:48]=[C:49]3[C:44]=2[CH2:43][CH2:42][CH2:41][N:40]3[C:38](=[O:39])[CH2:37][CH2:36][CH2:35][O:34][C:33]2[CH:60]=[CH:61][CH:62]=[C:63]([CH3:64])[C:32]=2[CH3:31])[CH:54]=[N:53]1)([CH3:5])[CH3:9]