Acetic Acid → HCID 67387573, compound
Reaction equation
[C:17]([CH3:18])([CH3:19])([CH3:20])[O:21][C:22](=[O:23])[N:24]1[CH2:25][CH2:26][N:27]([c:30]2[n:31][c:32]([C:39]#[N:40])[c:33]([C:37]#[N:38])[n:34][c:35]2[Cl:36])[CH2:28][CH2:29]1.[CH2:45]1[O:46][CH2:47][CH2:48][CH2:49]1.[CH3:10][CH:11]([N-:12][CH:13]([CH3:14])[CH3:15])[CH3:16].[CH3:41][C:42](=[O:43])[OH:44].[Li+:9].[n:1]1[cH:2][cH:3][c:4]([CH2:7][OH:8])[cH:5][cH:6]1>>[n:1]1[cH:2][cH:3][c:4]([CH2:7][O:8][c:35]2[c:30]([N:27]3[CH2:26][CH2:25][N:24]([C:22]([O:21][C:17]([CH3:18])([CH3:19])[CH3:20])=[O:23])[CH2:29][CH2:28]3)[n:31][c:32]([C:39]#[N:40])[c:33]([C:37]#[N:38])[n:34]2)[cH:5][cH:6]1Participants
7
Sources & evidence
- ORD record
- ord-1eccb10d87384e5db9ceb6d10dffb88d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
Loading…