Acetone → 2,6-Dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid monomethyl ester

HRID 681380Notes

Reaction equation

HRID 681380 reaction equation
[CH2:1]([O:2][CH2:3][N:5]1[C:6]([CH3:28])=[C:7]([C:24](=[O:25])[O:26][CH3:27])[CH:8]([c:15]2[cH:16][c:17]([N+:21](=[O:22])[O-:23])[cH:18][cH:19][cH:20]2)[C:9]([C:12](=[O:13])[OH:14])=[C:10]1[CH3:11])[CH3:4].[CH3:30][C:31](=[O:32])[CH3:33].[ClH:29]>>[NH:5]1[C:6]([CH3:28])=[C:7]([C:24](=[O:25])[O:26][CH3:27])[CH:8]([c:15]2[cH:16][c:17]([N+:21](=[O:22])[O-:23])[cH:18][cH:19][cH:20]2)[C:9]([C:12](=[O:13])[OH:14])=[C:10]1[CH3:11]

Participants

4

Reactant 3

HCID 180AcetoneHCID 313Hydrochloric AcidHCID 12602968(-)-1-Ethoxymethyl-2,6-dimethyl-3-carbomethoxy-4-(3-nitrophenyl)-5-carboxy-1,4-dihydropyridine

Product 1

HCID 1733222,6-Dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid monomethyl ester

Sources & evidence

ORD record
ord-28270be431cc4f44a809d096d51a2b26
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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