Toluene → HCID 86739444, compound
Reaction equation
[CH3:19][CH2:20][N:21]([CH2:22][CH3:23])[CH2:24][CH3:25].[CH3:45][c:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1.[OH:1][c:2]1[cH:3][cH:4][c:5]([N+:16](=[O:17])[O-:18])[c:6]2[n:7][c:8]3[cH:9][cH:10][cH:11][cH:12][c:13]3[cH:14][c:15]12.[P:26]([O:27][c:28]1[cH:29][cH:30][c:31]([C:34]([F:35])([F:36])[F:37])[cH:32][cH:33]1)([S:38][CH2:39][CH2:40][CH2:41][CH3:42])([Cl:43])=[O:44]>>[O:1]([c:2]1[cH:3][cH:4][c:5]([N+:16](=[O:17])[O-:18])[c:6]2[n:7][c:8]3[cH:9][cH:10][cH:11][cH:12][c:13]3[cH:14][c:15]12)[P:26]([O:27][c:28]1[cH:29][cH:30][c:31]([C:34]([F:35])([F:36])[F:37])[cH:32][cH:33]1)([S:38][CH2:39][CH2:40][CH2:41][CH3:42])=[O:44]Participants
5
Sources & evidence
- ORD record
- ord-3f71ca006c2148478dec7e6a69a9c841
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
Loading…