1-(Oxan-4-yl)piperazine → HCID 178425770, compound
Reaction equation
[O:1]=[C:2]1[NH:3][c:4]2[c:5]([cH:36][cH:37][cH:38][cH:39]2)[CH2:6][CH2:7][N:8]1[CH:9]1[CH2:10][CH2:11][N:12]([C:15](=[O:16])[O:17][CH:18]([CH2:19][c:20]2[cH:21][c:22]3[c:23]([nH:24][c:25]([N:27]([CH3:28])[CH3:29])[n:26]3)[c:30]([CH3:32])[cH:31]2)[C:33](=[O:34])[OH:35])[CH2:13][CH2:14]1.[O:40]1[CH2:41][CH2:42][CH:43]([N:46]2[CH2:47][CH2:48][NH:49][CH2:50][CH2:51]2)[CH2:44][CH2:45]1>>[O:1]=[C:2]1[NH:3][c:4]2[c:5]([cH:36][cH:37][cH:38][cH:39]2)[CH2:6][CH2:7][N:8]1[CH:9]1[CH2:10][CH2:11][N:12]([C:15](=[O:16])[O:17][CH:18]([CH2:19][c:20]2[cH:21][c:22]3[c:23]([nH:24][c:25]([N:27]([CH3:28])[CH3:29])[n:26]3)[c:30]([CH3:32])[cH:31]2)[C:33](=[O:35])[N:49]2[CH2:48][CH2:47][N:46]([CH:43]3[CH2:42][CH2:41][O:40][CH2:45][CH2:44]3)[CH2:51][CH2:50]2)[CH2:13][CH2:14]1Participants
3
Sources & evidence
- ORD record
- ord-0223bc69898a43eb8394e197eac5d1c4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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