Chloride → 7,8-dihydro-6,6-dimethyl-7-hydroxy-8-(2-oxo-3,3-dimethyl-1-piperidinyl)-6H-pyrano[2,3-f]benzo-2,1,3-oxadiazole

HRID 1547672Notes

Reaction equation

HRID 1547672 reaction equation
[Br:25][CH2:26][CH2:27][CH2:28][C:29]([C:30](=[O:31])[Cl:32])([CH3:33])[CH3:34].[CH3:18][CH2:19][N:20]([CH2:21][CH3:22])[CH2:23][CH3:24].[CH3:1][C:2]1([CH3:17])[CH:3]([OH:16])[CH:4]([NH2:15])[c:5]2[c:6]([cH:7][c:8]3[c:9]([n:10][o:11][n:12]3)[cH:13]2)[O:14]1.[CH3:37][CH2:38][O:39][C:40](=[O:41])[CH3:42].[Cl-:35].[Na+:36]>>[CH3:1][C:2]1([CH3:17])[CH:3]([OH:16])[CH:4]([N:15]2[CH2:26][CH2:27][CH2:28][C:29]([CH3:33])([CH3:34])[C:30]2=[O:31])[c:5]2[c:6]([cH:7][c:8]3[c:9]([n:10][o:11][n:12]3)[cH:13]2)[O:14]1

Participants

7

Reactant 6

HCID 312ChlorideHCID 923Sodium ionHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 11107308(+)-7,8-dihydro-6,6-dimethyl-7-hydroxy-8-amino-6H-pyrano[2,3-f]benz-2,1,3-oxadiazoleHCID 197348565-Bromo-2,2-dimethylvaleryl chloride

Product 1

HCID 197348437,8-dihydro-6,6-dimethyl-7-hydroxy-8-(2-oxo-3,3-dimethyl-1-piperidinyl)-6H-pyrano[2,3-f]benzo-2,1,3-oxadiazole

Sources & evidence

ORD record
ord-2b4a200bb88d4454878293d5febf8cf5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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