Ethyl Acetate → N-(1-phenyl-3-piperidinopropyl)quinaldinamide
반응식
[CH3:46][CH2:47][O:48][C:49](=[O:50])[CH3:51].[CH:15]1([N:16]=[C:17]=[N:18][CH:19]2[CH2:20][CH2:21][CH2:22][CH2:23][CH2:24]2)[CH2:25][CH2:26][CH2:27][CH2:28][CH2:29]1.[NH2:30][CH:31]([CH2:32][CH2:33][N:34]1[CH2:35][CH2:36][CH2:37][CH2:38][CH2:39]1)[c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1.[n:1]1[c:2]([CH2:3][C:4](=[O:5])[OH:6])[cH:7][cH:8][c:9]2[cH:10][cH:11][cH:12][cH:13][c:14]12>>[n:1]1[c:2]([CH2:3][C:4](=[O:6])[NH:30][CH:31]([CH2:32][CH2:33][N:34]2[CH2:35][CH2:36][CH2:37][CH2:38][CH2:39]2)[c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[cH:7][cH:8][c:9]2[cH:10][cH:11][cH:12][cH:13][c:14]12참가 물질
5
출처 및 근거
- ORD 기록
- ord-e1ee4be6a4f44c73bf41059bad7633ba
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
- DOI