Hydrochloric Acid → HCID 21704779, compound
Reaction equation
[CH2:35]([O:36][CH:37]([OH:38])[CH3:39])[CH3:40].[Cl:1][c:2]1[c:3]([C:16]#[N:17])[cH:4][n:5][c:6]2[cH:7][c:8]([O:14][CH3:15])[c:9]([O:12][CH3:13])[cH:10][c:11]12.[ClH:28].[ClH:47].[NH2:18][c:19]1[c:20]2[cH:21][cH:22][nH:23][c:24]2[cH:25][cH:26][cH:27]1.[Na+:41].[Na+:42].[O-:43][C:44](=[O:45])[O-:46].[OH2:48].[n:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1>>[c:2]1([NH:18][c:19]2[c:20]3[cH:21][cH:22][nH:23][c:24]3[cH:25][cH:26][cH:27]2)[c:3]([C:16]#[N:17])[cH:4][n:5][c:6]2[cH:7][c:8]([O:14][CH3:15])[c:9]([O:12][CH3:13])[cH:10][c:11]12Participants
9
Sources & evidence
- ORD record
- ord-44c2d6fa00d24f96a80cdc423f6b2d14
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
Loading…