Acetic Acid → HCID 21188110, compound
Reaction equation
[CH3:28][C:29](=[O:30])[OH:31].[NH2:1][c:2]1[cH:3][c:4]([C:19]#[N:20])[n:5][n:6]1-[c:7]1[c:8]([Cl:18])[cH:9][c:10]([C:14]([F:15])([F:16])[F:17])[cH:11][c:12]1[Cl:13].[O:21]=[C:22]1[CH2:23][CH2:24][CH2:25][CH2:26][CH2:27]1.[OH2:32]>>[NH2:1][c:2]1[c:3]([C:22]2=[CH:23][CH2:24][CH2:25][CH2:26][CH2:27]2)[c:4]([C:19]#[N:20])[n:5][n:6]1-[c:7]1[c:8]([Cl:18])[cH:9][c:10]([C:14]([F:15])([F:16])[F:17])[cH:11][c:12]1[Cl:13]Participants
5
Sources & evidence
- ORD record
- ord-1ab26a28e2ba4f9b85b0a3314b6a5a7a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
Loading…