Acetic Acid → HCID 87305115, compound
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH:10]([CH3:49])[N:11]([c:14]2[cH:15][c:16](-[c:41]3[c:42]([CH3:48])[cH:43][c:44]([F:47])[cH:45][cH:46]3)[c:17]([N:20]([C:21]([C:22]([CH3:23])([CH3:24])[c:25]3[cH:26][c:27]([C:35]([F:36])([F:37])[F:38])[cH:28][c:29]([C:31]([F:32])([F:33])[F:34])[cH:30]3)=[O:39])[CH3:40])[cH:18][n:19]2)[CH2:12][CH2:13]1.[CH3:50][C:51](=[O:52])[OH:53]>>[NH:8]1[CH2:9][CH:10]([CH3:49])[N:11]([c:14]2[cH:15][c:16](-[c:41]3[c:42]([CH3:48])[cH:43][c:44]([F:47])[cH:45][cH:46]3)[c:17]([N:20]([C:21]([C:22]([CH3:23])([CH3:24])[c:25]3[cH:26][c:27]([C:35]([F:36])([F:37])[F:38])[cH:28][c:29]([C:31]([F:32])([F:33])[F:34])[cH:30]3)=[O:39])[CH3:40])[cH:18][n:19]2)[CH2:12][CH2:13]1Participants
3
Sources & evidence
- ORD record
- ord-8286693dccd34c60be087c1ffbd534c4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
Loading…