3-Methylmorpholine → 1-[3-Chloro-5-[3-(4-fluorophenyl)butoxy]-4-methoxy-2-methyl-6-[2-(3-methylmorpholin-4-yl)ethoxy]phenyl]ethanone

반응식

[Br:1][CH2:2][CH2:3][O:4][c:5]1[c:6]([C:27]([CH3:28])=[O:29])[c:7]([CH3:26])[c:8]([Cl:25])[c:9]([O:23][CH3:24])[c:10]1[O:11][CH2:12][CH2:13][CH:14]([CH3:15])[c:16]1[cH:17][cH:18][c:19]([F:22])[cH:20][cH:21]1.[CH3:30][CH:31]1[CH2:32][O:33][CH2:34][CH2:35][NH:36]1>>[CH2:2]([CH2:3][O:4][c:5]1[c:6]([C:27]([CH3:28])=[O:29])[c:7]([CH3:26])[c:8]([Cl:25])[c:9]([O:23][CH3:24])[c:10]1[O:11][CH2:12][CH2:13][CH:14]([CH3:15])[c:16]1[cH:17][cH:18][c:19]([F:22])[cH:20][cH:21]1)[N:36]1[CH:31]([CH3:30])[CH2:32][O:33][CH2:34][CH2:35]1

참가 물질

반응물 2

HCID 2921033-Methylmorpholine

HCID 595835231-{2-(2-Bromo-ethoxy)-5-chloro-3-[3-(4-fluoro-phenyl)-butoxy]-4-methoxy-6-methyl-phenyl}-ethanone

생성물 1

HCID 744351941-[3-Chloro-5-[3-(4-fluorophenyl)butoxy]-4-methoxy-2-methyl-6-[2-(3-methylmorpholin-4-yl)ethoxy]phenyl]ethanone

출처 및 근거

ORD 기록: ord-5701911f1b9b4cb88fd47c48853057c9
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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