Ethyl Acetate → 4-[4-[4-(2-Fluoroethyl)-1-piperazinyl]-1-piperidinyl]-2-(methyloxy)aniline

반응식

[CH3:29][CH2:30][O:31][C:32]([CH3:33])=[O:34].[F:1][CH2:2][CH2:3][N:4]1[CH2:5][CH2:6][N:7]([CH:10]2[CH2:11][CH2:12][N:13]([c:16]3[cH:17][c:18]([O:25][CH3:26])[c:19]([N+:22]([O-:23])=[O:24])[cH:20][cH:21]3)[CH2:14][CH2:15]2)[CH2:8][CH2:9]1.[H:27][H:28]>>[F:1][CH2:2][CH2:3][N:4]1[CH2:5][CH2:6][N:7]([CH:10]2[CH2:11][CH2:12][N:13]([c:16]3[cH:17][c:18]([O:25][CH3:26])[c:19]([NH2:22])[cH:20][cH:21]3)[CH2:14][CH2:15]2)[CH2:8][CH2:9]1

참가 물질

반응물 3

HCID 8857Ethyl Acetate

HCID 598602761-(2-Fluoroethyl)-4-{1-[3-(methyloxy)-4-nitrophenyl]-4-piperidinyl}piperazine

HCID 178418361HCID 178418361, 화합물

생성물 1

HCID 598602604-[4-[4-(2-Fluoroethyl)-1-piperazinyl]-1-piperidinyl]-2-(methyloxy)aniline

출처 및 근거

ORD 기록: ord-d3871d06e8bb4df8bc9cac5951a7a965
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

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