HRID931776

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：Cc1cc2c(ccc(C)[n+]2[O-])c(-c2ccc(Cl)cc2)c1[C@@H](COC(=O)C(C)(C)C)OC(C)(C)C

HCID66631094

未命名化合物

结构：CCOC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2nc(CN(C)c3ccccc3)ccc2c1-c1ccc(Cl)cc1

HCID68591259

未命名化合物

PRODUCTS

生成物

结构：Cc1cc2nc(CN(C)c3ccccc3)ccc2c(-c2ccc(Cl)cc2)c1[C@@H](COC(=O)C(C)(C)C)OC(C)(C)C

HCID66630519

未命名化合物

PROCEDURE

实验过程

(S)-2-tert-Butoxy-2-(5-(4-chlorophenyl)-7-methyl-2-((methyl(phenyl)amino)methyl)quinolin-6-yl)ethyl pivalate was prepared following the procedure used to prepare compound (S)-ethyl 2-tert-butoxy-2-(5-(4-chlorophenyl)-7-methyl-2-((methyl(phenyl)amino)methyl)quinolin-6-yl)acetate of Example 14, except that (S)-6-(1-tert-butoxy-2-(pivaloyloxy)ethyl)-5-(4-chlorophenyl)-2,7-dimethylquinoline 1-oxide was used instead of (S)-6-(1-tert-butoxy-2-ethoxy-2-oxoethyl)-5-(4-chlorophenyl)-2,7-dimethylquinoline 1-oxide. LCMS-ESI+ (m/z): 573.3, 575.4 (M+H)+.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c65a1517c1604f429e9abb7156fac43b
来源数据集: uspto-grants-2016_03
DOI: 10.6084/m9.figshare.5104873.v1
专利: US09296758B2
来源说明: uspto-grants-2016_03

反应 SMILES

[C:1]([O:5][C@@H:6]([C:12]1[C:13]([C:32]2[CH:37]=[CH:36][C:35]([Cl:38])=[CH:34][CH:33]=2)=[C:14]2[C:19](=[CH:20][C:21]=1[CH3:22])[N:18]=[C:17]([CH2:23][N:24]([CH3:31])[C:25]1[CH:30]=[CH:29][CH:28]=[CH:27][CH:26]=1)[CH:16]=[CH:15]2)[C:7](OCC)=[O:8])([CH3:4])([CH3:3])[CH3:2].C(O[C@@H](C1C(C2C=CC(Cl)=CC=2)=C2C(=CC=1C)[N+]([O-])=C(C)C=C2)C[O:46][C:47](=O)[C:48]([CH3:51])([CH3:50])[CH3:49])(C)(C)C>>[C:47]([O:8][CH2:7][C@@H:6]([O:5][C:1]([CH3:4])([CH3:2])[CH3:3])[C:12]1[C:13]([C:32]2[CH:37]=[CH:36][C:35]([Cl:38])=[CH:34][CH:33]=2)=[C:14]2[C:19](=[CH:20][C:21]=1[CH3:22])[N:18]=[C:17]([CH2:23][N:24]([CH3:31])[C:25]1[CH:26]=[CH:27][CH:28]=[CH:29][CH:30]=1)[CH:16]=[CH:15]2)(=[O:46])[C:48]([CH3:51])([CH3:50])[CH3:49]