3-Aminoquinuclidine → N-[[[1-Azabicyclo[2.2.2]octan-3-yl]amino]carbonyl]-2-methoxybenzamide

반응식

[C:23]([O-:24])(=[O:25])[CH:26]=[CH:27][C:28]([O-:29])=[O:30].[CH3:10][O:11][c:12]1[c:13]([C:14](=[O:15])[N:16]=[C:17]=[O:18])[cH:19][cH:20][cH:21][cH:22]1.[NH2:1][CH:2]1[CH2:3][N:4]2[CH2:5][CH2:6][CH:7]1[CH2:8][CH2:9]2>>[NH:1]([CH:2]1[CH2:3][N:4]2[CH2:5][CH2:6][CH:7]1[CH2:8][CH2:9]2)[C:17]([NH:16][C:14]([c:13]1[c:12]([O:11][CH3:10])[cH:22][cH:21][cH:20][cH:19]1)=[O:15])=[O:18]

참가 물질

반응물 3

HCID 1232383-Aminoquinuclidine

HCID 164547Butenedioate

HCID 141193282-Methoxybenzoyl isocyanate

생성물 1

HCID 15616380N-[[[1-Azabicyclo[2.2.2]octan-3-yl]amino]carbonyl]-2-methoxybenzamide

출처 및 근거

ORD 기록: ord-a6496b7c402c4266b2ea0ffea3769339
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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