1-Butanol → HCID 178452840, compound
Reaction equation
[C:11]([CH3:12])([CH3:13])([CH3:14])[O:15][C:16]([NH:17][CH:18]1[CH2:19][CH2:20][NH:21][CH2:22][CH2:23]1)=[O:24].[CH2:32]([OH:33])[CH2:34][CH2:35][CH3:36].[CH3:25][CH2:26][N:27]([CH2:28][CH3:29])[CH2:30][CH3:31].[Cl:1][c:2]1[c:3]2[nH:4][cH:5][n:6][c:7]2[n:8][cH:9][n:10]1>>[c:2]1([N:21]2[CH2:20][CH2:19][CH:18]([NH:17][C:16]([O:15][C:11]([CH3:12])([CH3:13])[CH3:14])=[O:24])[CH2:23][CH2:22]2)[c:3]2[n:4][cH:5][nH:6][c:7]2[n:8][cH:9][n:10]1Participants
5
Sources & evidence
- ORD record
- ord-3d52e666c6274bf899dc6a572adad49b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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