2-((4-Nitrophenoxy)methyl)oxirane → 1-[4-(1H-indol-4-yl)piperazin-1-yl]-3-(4-nitrophenoxy)propan-2-ol
반응식
[O:1]1[CH2:2][CH:3]1[CH2:4][O:5][c:6]1[cH:7][cH:8][c:9]([N+:12](=[O:13])[O-:14])[cH:10][cH:11]1.[nH:15]1[cH:16][cH:17][c:18]2[c:19]([N:24]3[CH2:25][CH2:26][NH:27][CH2:28][CH2:29]3)[cH:20][cH:21][cH:22][c:23]12>>[OH:1][CH:3]([CH2:2][N:27]1[CH2:26][CH2:25][N:24]([c:19]2[c:18]3[cH:17][cH:16][nH:15][c:23]3[cH:22][cH:21][cH:20]2)[CH2:29][CH2:28]1)[CH2:4][O:5][c:6]1[cH:7][cH:8][c:9]([N+:12](=[O:13])[O-:14])[cH:10][cH:11]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-5caced303f474c8c93354ab5bc426b4e
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
반응 노트
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