HRID1930227

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID643502

n-boc-4-hydroxypiperidine

C10H19NO3

结构：COc1ccc(Cn2ccc3cc(OC4CCN(C(=O)OC(C)(C)C)CC4)c(-c4ccccc4)cc3c2=O)cc1

HCID57652576

未命名化合物

HCID59818258

7-Ethyl-6-fluoro-2-[(4-methoxyphenyl)methyl]isoquinolin-1(2H)-one

C19H18FNO2

PRODUCTS

生成物

结构：CCc1cc2c(=O)n(Cc3ccc(OC)cc3)ccc2cc1OC1CCN(C(=O)OC(C)(C)C)CC1

HCID57652598

未命名化合物

PROCEDURE

实验过程

The title compound was synthesized following the method described for 4-[2-(4-methoxy-benzyl)-1-oxo-7-phenyl-1,2-dihydro-isoquinolin-6-yloxy]-piperidine-1-carboxylic acid tert-butyl ester (316), starting from 7-ethyl-6-fluoro-2-(4-methoxy-benzyl)-2H-isoquinolin-1-one (318) and 4-hydroxy-piperidine-1-carboxylic acid tert-butyl ester. Rt=1.91 min (Method C). Detected mass: 493.6 (M+H+).

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-558a788bce204a7fb821588562297d94
来源数据集: uspto-grants-2012_05
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08188117B2
来源说明: uspto-grants-2012_05

反应 SMILES

[C:1]([O:5][C:6]([N:8]1[CH2:13][CH2:12][CH:11]([O:14][C:15]2[CH:16]=[C:17]3[C:22](=[CH:23][C:24]=2[C:25]2C=CC=C[CH:26]=2)[C:21](=[O:31])[N:20]([CH2:32][C:33]2[CH:38]=[CH:37][C:36]([O:39][CH3:40])=[CH:35][CH:34]=2)[CH:19]=[CH:18]3)[CH2:10][CH2:9]1)=[O:7])([CH3:4])([CH3:3])[CH3:2].C(C1C=C2C(C=CN(CC3C=CC(OC)=CC=3)C2=O)=CC=1F)C.C(OC(N1CCC(O)CC1)=O)(C)(C)C>>[C:1]([O:5][C:6]([N:8]1[CH2:9][CH2:10][CH:11]([O:14][C:15]2[CH:16]=[C:17]3[C:22](=[CH:23][C:24]=2[CH2:25][CH3:26])[C:21](=[O:31])[N:20]([CH2:32][C:33]2[CH:38]=[CH:37][C:36]([O:39][CH3:40])=[CH:35][CH:34]=2)[CH:19]=[CH:18]3)[CH2:12][CH2:13]1)=[O:7])([CH3:4])([CH3:2])[CH3:3]