Water → HCID 54045666, compound
Reaction equation
[CH2:25]([CH3:26])[O:27][CH2:28][CH:29]1[CH2:30][CH2:31][CH:32]([c:35]2[cH:36][cH:37][c:38]([C:39](=[O:40])[Cl:41])[cH:42][cH:43]2)[CH2:33][CH2:34]1.[CH3:18][c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1.[F:1][c:2]1[c:3]([C:4]#[N:5])[c:6]([F:11])[cH:7][c:8]([OH:10])[cH:9]1.[OH2:44].[cH:12]1[cH:13][cH:14][n:15][cH:16][cH:17]1>>[F:1][c:2]1[c:3]([C:4]#[N:5])[c:6]([F:11])[cH:7][c:8]([O:10][C:39]([c:38]2[cH:37][cH:36][c:35]([CH:32]3[CH2:31][CH2:30][CH:29]([CH2:28][O:27][CH2:25][CH3:26])[CH2:34][CH2:33]3)[cH:43][cH:42]2)=[O:40])[cH:9]1Participants
6
Sources & evidence
- ORD record
- ord-87786264eaee43789d56fef293a2f644
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
Loading…