Acetic Acid → HCID 54172310, compound

HRID 100639Notes

Reaction equation

HRID 100639 reaction equation
[C:12]([CH2:13][CH3:14])(=[O:15])[CH2:16][C:17](=[O:18])[O:19][CH2:20][CH2:21][C:22]#[N:23].[CH2:24]1[CH2:25][CH2:26][NH:27][CH2:28][CH2:29]1.[CH3:30][C:31](=[O:32])[OH:33].[CH3:34][CH:35]([OH:36])[CH3:37].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([CH:8]=[O:9])[cH:10][cH:11]1>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([CH:8]=[C:16]([C:12]([CH2:13][CH3:14])=[O:15])[C:17](=[O:18])[O:19][CH2:20][CH2:21][C:22]#[N:23])[cH:10][cH:11]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 5414-NitrobenzaldehydeHCID 3776IsopropanolHCID 8082PiperidineHCID 22725151HCID 22725151, compound

Product 1

HCID 54172310HCID 54172310, compound

Sources & evidence

ORD record
ord-2415fd03505a4af4a42b7be496b53f99
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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