Hydrochloric Acid → 4-[3-(6-Cyano-3-oxo-1,4-benzoxazin-4-yl)propyl]-1-[3-(2,5-difluorophenyl)prop-2-enyl]piperidine-3-carboxylic acid
Reaction equation
[CH3:41][OH:42].[ClH:40].[F:1][c:2]1[c:3]([CH:9]=[CH:10][CH2:11][N:12]2[CH2:13][CH:14]([C:34](=[O:35])[O:36][CH3:37])[CH:15]([CH2:18][CH2:19][CH2:20][N:21]3[C:22](=[O:33])[CH2:23][O:24][c:25]4[c:26]3[cH:27][c:28]([C:31]#[N:32])[cH:29][cH:30]4)[CH2:16][CH2:17]2)[cH:4][c:5]([F:8])[cH:6][cH:7]1.[Na+:39].[OH-:38].[OH2:43]>>[F:1][c:2]1[c:3]([CH:9]=[CH:10][CH2:11][N:12]2[CH2:13][CH:14]([C:34](=[O:35])[OH:36])[CH:15]([CH2:18][CH2:19][CH2:20][N:21]3[C:22](=[O:33])[CH2:23][O:24][c:25]4[c:26]3[cH:27][c:28]([C:31]#[N:32])[cH:29][cH:30]4)[CH2:16][CH2:17]2)[cH:4][c:5]([F:8])[cH:6][cH:7]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-f59b6ae134b24d70a9206e86935fef18
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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