Benzene → 1-(N-methylamino)carbonyl-4-(4-nitrophenoxy)-4-phenylpiperidine

반응식

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

참가 물질

반응물 3

HCID 241Benzene

HCID 12228Methyl Isocyanate

HCID 200299564-(4-Nitrophenoxy)-4-phenylpiperidine

생성물 1

HCID 146499881-(N-methylamino)carbonyl-4-(4-nitrophenoxy)-4-phenylpiperidine

출처 및 근거

ORD 기록: ord-7340ba90e92549559b384646fbe24736
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

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