Dimethylamine → 5-dimethylamino-2-nitro-N-[(1-diphenylmethylpiperidin-4-yl)methyl]benzamide
反応式
[CH2:39]1[O:40][CH2:41][CH2:42][CH2:43]1.[CH3:34][OH:35].[CH3:36][NH:37][CH3:38].[F:1][c:2]1[cH:3][cH:4][c:5]([N+:31](=[O:32])[O-:33])[c:6]([C:7](=[O:8])[NH:9][CH2:10][CH:11]2[CH2:12][CH2:13][N:14]([CH:17]([c:18]3[cH:19][cH:20][cH:21][cH:22][cH:23]3)[c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)[CH2:15][CH2:16]2)[cH:30]1>>[c:2]1([N:37]([CH3:36])[CH3:38])[cH:3][cH:4][c:5]([N+:31](=[O:32])[O-:33])[c:6]([C:7](=[O:8])[NH:9][CH2:10][CH:11]2[CH2:12][CH2:13][N:14]([CH:17]([c:18]3[cH:19][cH:20][cH:21][cH:22][cH:23]3)[c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)[CH2:15][CH2:16]2)[cH:30]1参加物
5
出典と根拠
- ORDレコード
- ord-b241a1fb21844be8b5e2e88eeec3cbe8
- 出典データセット
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)