Methanol → 3-[1-Hydroxy-4-(1-benzylpiperidin-4-yl)butyl]-5-(4-nitrophenyl)-1,2,4-oxadiazole

HRID 1149450Notes

Reaction equation

HRID 1149450 reaction equation
[C:1](=[O:2])([CH3:3])[O:4][CH:5]([CH2:6][CH2:7][CH2:8][CH:9]1[CH2:10][CH2:11][N:12]([CH2:15][c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[CH2:13][CH2:14]1)[c:22]1[n:23][o:24][c:25](-[c:27]2[cH:28][cH:29][c:30]([N+:33](=[O:34])[O-:35])[cH:31][cH:32]2)[n:26]1.[CH3:39][OH:40].[Na+:37].[OH-:36].[OH2:38]>>[OH:4][CH:5]([CH2:6][CH2:7][CH2:8][CH:9]1[CH2:10][CH2:11][N:12]([CH2:15][c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[CH2:13][CH2:14]1)[c:22]1[n:23][o:24][c:25](-[c:27]2[cH:28][cH:29][c:30]([N+:33](=[O:34])[O-:35])[cH:31][cH:32]2)[n:26]1

Participants

6

Reactant 5

HCID 887MethanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 199591703-[1-Acetoxy-4-(1-benzylpiperidin-4-yl)butyl]-5-(4-nitrophenyl)-1,2,4-oxadiazole

Product 1

HCID 199592433-[1-Hydroxy-4-(1-benzylpiperidin-4-yl)butyl]-5-(4-nitrophenyl)-1,2,4-oxadiazole

Sources & evidence

ORD record
ord-b0984bc9fc3a42eaa11b2e0cd61a4e3e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

Loading…