Acetic Acid → N,N-Dimethyl-2-cyano-3-(3,4-dihydroxy-5-nitrophenyl)acrylamide

HRID 91686

Reaction equation

HRID 91686 reaction equation
[C:22]([OH:23])(=[O:24])[CH3:25].[CH3:14][N:15]([C:16]([CH2:17][C:18]#[N:19])=[O:20])[CH3:21].[CH3:32][CH2:33][OH:34].[NH:26]1[CH2:27][CH2:28][CH2:29][CH2:30][CH2:31]1.[OH:1][c:2]1[cH:3][c:4]([CH:5]=[O:6])[cH:7][c:8]([N+:11](=[O:12])[O-:13])[c:9]1[OH:10]>>[OH:1][c:2]1[cH:3][c:4]([CH:5]=[C:17]([C:16]([N:15]([CH3:14])[CH3:21])=[O:20])[C:18]#[N:19])[cH:7][c:8]([N+:11](=[O:12])[O-:13])[c:9]1[OH:10]

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 702EthanolHCID 8082PiperidineHCID 2511432-Cyano-N,N-dimethylacetamideHCID 57489573,4-Dihydroxy-5-nitrobenzaldehyde

Product 1

HCID 54424215N,N-Dimethyl-2-cyano-3-(3,4-dihydroxy-5-nitrophenyl)acrylamide

Sources & evidence

ORD record
ord-eee0843a5fa545aa93f1f76272d35d7b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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