Hydrochloric Acid → N-(1-azabicyclo[2.2.2]octan-3-yl)-3-(5-nitrofuran-2-yl)prop-2-enamide

반응식

[ClH:1].[ClH:2].[N+:12](=[O:13])([O-:14])[c:15]1[cH:16][cH:17][c:18]([CH:20]=[CH:21][C:22](=[O:23])[OH:24])[o:19]1.[N:3]12[CH2:4][CH:5]([NH2:11])[CH:6]([CH2:7][CH2:8]1)[CH2:9][CH2:10]2>>[N:3]12[CH2:4][CH:5]([NH:11][C:22]([CH:21]=[CH:20][c:18]3[cH:17][cH:16][c:15]([N+:12](=[O:13])[O-:14])[o:19]3)=[O:23])[CH:6]([CH2:7][CH2:8]1)[CH2:9][CH2:10]2

참가 물질

반응물 3

HCID 313Hydrochloric Acid2회

HCID 226803-(5-Nitro-2-furyl)prop-2-enoic acid

HCID 1232383-Aminoquinuclidine

생성물 1

HCID 69627400N-(1-azabicyclo[2.2.2]octan-3-yl)-3-(5-nitrofuran-2-yl)prop-2-enamide

출처 및 근거

ORD 기록: ord-78379da70edb441cbd990c426db7cf95
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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