Ammonium → 6-nitro-2,2-dimethyl-3-aminomethyl-4-(2-oxo-1,2-dihydropyridin-1-yl)-2H-1-benzopyran

HRID 1125775Notes

Reaction equation

HRID 1125775 reaction equation
[CH3:27][CH2:28][OH:29].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]2[c:8]([cH:24]1)[C:9]([n:17]1[c:18](=[O:23])[cH:19][cH:20][cH:21][cH:22]1)=[C:10]([CH2:15][Br:16])[C:11]([CH3:13])([CH3:14])[O:12]2.[NH4+:25].[OH-:26]>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]2[c:8]([cH:24]1)[C:9]([n:17]1[c:18](=[O:23])[cH:19][cH:20][cH:21][cH:22]1)=[C:10]([CH2:15][NH2:25])[C:11]([CH3:13])([CH3:14])[O:12]2

Participants

5

Reactant 4

HCID 223AmmoniumHCID 702EthanolHCID 961HydroxideHCID 193872966-nitro-2,2-dimethyl-3-bromomethyl-4-(2-oxo-1,2-dihydropyridin-1-yl)-2H-1-benzopyran

Product 1

HCID 193870526-nitro-2,2-dimethyl-3-aminomethyl-4-(2-oxo-1,2-dihydropyridin-1-yl)-2H-1-benzopyran

Sources & evidence

ORD record
ord-d3097a860c304fa2a3e85aca9e767b30
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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