Ethyl Acetate → HCID 66892876, compound
Reaction equation
[CH3:1][O:2][c:3]1[c:4]([N:12]2[CH2:13][CH2:14][N:15]([CH2:19][c:20]3[cH:21][n:22][c:23](-[c:25]4[cH:26][cH:27][cH:28][cH:29][cH:30]4)[s:24]3)[CH2:16][CH2:17][CH2:18]2)[c:5]([N+:9]([O-:10])=[O:11])[cH:6][cH:7][cH:8]1.[CH3:31][CH2:32][O:33][C:34](=[O:35])[CH3:36]>>[CH3:1][O:2][c:3]1[c:4]([N:12]2[CH2:13][CH2:14][N:15]([CH2:19][c:20]3[cH:21][n:22][c:23](-[c:25]4[cH:26][cH:27][cH:28][cH:29][cH:30]4)[s:24]3)[CH2:16][CH2:17][CH2:18]2)[c:5]([NH2:9])[cH:6][cH:7][cH:8]1Participants
3
Sources & evidence
- ORD record
- ord-391ec7556181467f80fc565e9b3cc310
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
Loading…