Toluene → HCID 86626163, compound
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][c:11]2[c:12]([NH:22][CH2:23][CH2:24][CH2:25][CH2:26][NH:27][C:28]([O:29][C:30]([CH3:31])([CH3:32])[CH3:33])=[O:34])[c:13]([N+:19]([O-:20])=[O:21])[cH:14][n:15][c:16]2[cH:17][cH:18]1.[CH3:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][c:11]2[c:12]([NH:22][CH2:23][CH2:24][CH2:25][CH2:26][NH:27][C:28]([O:29][C:30]([CH3:31])([CH3:32])[CH3:33])=[O:34])[c:13]([NH2:19])[cH:14][n:15][c:16]2[cH:17][cH:18]1Participants
3
Sources & evidence
- ORD record
- ord-a879573e49d142739dede1ed51c3ee3c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
Loading…