N-(2-Hydroxyethyl)phthalimide → 2-{2-[3-(4-{[benzyl(2-methyl-3-nitrophenyl)amino]methyl}phenoxy)phenoxy]ethyl}-1H-isoindole-1,3(2H)-dione
반응식
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]([c:9]1[c:10]([CH3:18])[c:11]([N+:15](=[O:16])[O-:17])[cH:12][cH:13][cH:14]1)[CH2:19][c:20]1[cH:21][cH:22][c:23]([O:24][c:25]2[cH:26][c:27]([OH:31])[cH:28][cH:29][cH:30]2)[cH:32][cH:33]1.[OH:34][CH2:35][CH2:36][N:37]1[C:38](=[O:47])[c:39]2[c:40]([cH:43][cH:44][cH:45][cH:46]2)[C:41]1=[O:42]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]([c:9]1[c:10]([CH3:18])[c:11]([N+:15](=[O:16])[O-:17])[cH:12][cH:13][cH:14]1)[CH2:19][c:20]1[cH:21][cH:22][c:23]([O:24][c:25]2[cH:26][c:27]([O:31][CH2:35][CH2:36][N:37]3[C:38](=[O:47])[c:39]4[c:40]([cH:43][cH:44][cH:45][cH:46]4)[C:41]3=[O:42])[cH:28][cH:29][cH:30]2)[cH:32][cH:33]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-effd5240b2f44c0da0c0cf56a6b515e7
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
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