Acetic Acid → HCID 14986507, compound

HRID 1567729Notes

Reaction equation

HRID 1567729 reaction equation
[Br-:27].[CH3:29][C:30](=[O:31])[OH:32].[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[NH:8][CH:9]2[c:10]3[c:11]([cH:18][cH:19][s:20]3)[O:12][C:13]([CH3:16])([CH3:17])[CH:14]2[OH:15])[cH:21][cH:22]1.[K+:28].[OH:23][N+:24]([O-:25])=[O:26]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[NH:8][CH:9]2[c:10]3[c:11]([cH:18][c:19]([N+:24](=[O:23])[O-:25])[s:20]3)[O:12][C:13]([CH3:16])([CH3:17])[CH:14]2[OH:15])[cH:21][cH:22]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 259Bromide ionHCID 813Potassium CationHCID 944Nitric AcidHCID 149865067-(4-Chlorobenzamido)-5,6-dihydro-6-hydroxy-5,5-dimethyl-7H-thieno[3,2-b]pyran

Product 1

HCID 14986507HCID 14986507, compound

Sources & evidence

ORD record
ord-89761f5a1e9a4d999b1aad2d3d9e7e47
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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