Benzene → 4-[3-[3-(Decylamino)-3-oxoprop-1-enyl]anilino]-4-oxobut-2-enoic acid
Reaction equation
[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH3:10])[NH:11][C:12]([CH:13]=[CH:14][c:15]1[cH:16][c:17]([NH2:21])[cH:18][cH:19][cH:20]1)=[O:22].[O:23]=[C:24]1[O:25][C:26](=[O:27])[CH:28]=[CH:29]1.[cH:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1>>[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH3:10])[NH:11][C:12]([CH:13]=[CH:14][c:15]1[cH:16][c:17]([NH:21][C:26](=[O:27])[CH:28]=[CH:29][C:24](=[O:23])[OH:25])[cH:18][cH:19][cH:20]1)=[O:22]Participants
4
Sources & evidence
- ORD record
- ord-9dad9c7202194a97834722bc65b75dda
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
Loading…