Toluene → Benzoic acid, 3-(aminocarbonyl)-, methyl ester
반응식
[CH3:1][O:2][C:3](=[O:4])[c:5]1[cH:6][c:7]([C:8](=[O:9])[OH:10])[cH:11][cH:12][cH:13]1.[CH3:23][c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1.[O:18]=[CH:19][N:20]([CH3:21])[CH3:22].[S:14]([Cl:15])([Cl:16])=[O:17]>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[cH:6][c:7]([C:8](=[O:9])[NH2:20])[cH:11][cH:12][cH:13]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-549a39dc56014ee396913ed072e13604
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
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