Ethyl 4-aminobicyclo[2.2.2]octane-1-carboxylate → HCID 178468403, compound
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[N:11]([C:12]12[CH2:13][CH2:14][C:15]([C:20](=[O:21])[O:22][n:23]3[c:24]4[cH:25][cH:26][cH:27][cH:28][c:29]4[n:30][n:31]3)([CH2:16][CH2:17]1)[CH2:18][CH2:19]2)[CH2:32][C:33](=[O:34])[N:35]1[CH:36]([C:41]#[N:42])[CH2:37][CH:38]([F:40])[CH2:39]1.[NH2:43][C:44]12[CH2:45][CH2:46][C:47]([C:52](=[O:53])[O:54][CH2:55][CH3:56])([CH2:48][CH2:49]1)[CH2:50][CH2:51]2>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[N:11]([C:12]12[CH2:13][CH2:14][C:15]([C:20](=[O:21])[NH:43][C:44]34[CH2:45][CH2:46][C:47]([C:52](=[O:53])[O:54][CH2:55][CH3:56])([CH2:48][CH2:49]3)[CH2:50][CH2:51]4)([CH2:16][CH2:17]1)[CH2:18][CH2:19]2)[CH2:32][C:33](=[O:34])[N:35]1[CH:36]([C:41]#[N:42])[CH2:37][CH:38]([F:40])[CH2:39]1Participants
3
Sources & evidence
- ORD record
- ord-a1213180a8bf4376809d14ef3a7a72ea
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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