Benzene → HCID 12912194, compound
Reaction equation
[CH2:1]([CH:2]=[CH2:3])[n:4]1[n:5][c:6]([CH3:20])[c:7]([C:10]([c:11]2[c:12]([Cl:18])[cH:13][c:14]([Cl:17])[cH:15][cH:16]2)=[O:19])[c:8]1[OH:9].[CH3:27][CH2:28][N:29]([CH2:30][CH3:31])[CH2:32][CH3:33].[OH2:45].[c:34]1([CH3:44])[cH:35][cH:36][c:37]([S:40](=[O:41])(=[O:42])[Cl:43])[cH:38][cH:39]1.[cH:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1>>[CH2:1]([CH:2]=[CH2:3])[n:4]1[n:5][c:6]([CH3:20])[c:7]([C:10]([c:11]2[c:12]([Cl:18])[cH:13][c:14]([Cl:17])[cH:15][cH:16]2)=[O:19])[c:8]1[O:9][S:40]([c:37]1[cH:36][cH:35][c:34]([CH3:44])[cH:39][cH:38]1)(=[O:41])=[O:42]Participants
6
Sources & evidence
- ORD record
- ord-ff1a80ef7f384210a36e035a213ebe2b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
Loading…