Acetic Acid → HCID 22013889, compound

HRID 2137100Notes

Reaction equation

HRID 2137100 reaction equation
[C:24]([CH2:25][C:26](=[O:27])[O:28][CH:29]([CH3:30])[CH3:31])(=[O:32])[O:33][CH:34]([CH3:35])[CH3:36].[CH2:41]1[CH2:42][CH2:43][NH:44][CH2:45][CH2:46]1.[CH3:1][c:2]1[c:3]([CH2:13][CH2:14][O:15][c:16]2[cH:17][cH:18][c:19]([CH:20]=[O:21])[cH:22][cH:23]2)[n:4][c:5](-[c:7]2[cH:8][cH:9][cH:10][cH:11][cH:12]2)[o:6]1.[CH3:37][C:38](=[O:39])[OH:40].[CH3:47][c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1>>[CH3:1][c:2]1[c:3]([CH2:13][CH2:14][O:15][c:16]2[cH:17][cH:18][c:19]([CH:20]=[C:25]([C:24](=[O:32])[O:33][CH:34]([CH3:35])[CH3:36])[C:26](=[O:27])[O:28][CH:29]([CH3:30])[CH3:31])[cH:22][cH:23]2)[n:4][c:5](-[c:7]2[cH:8][cH:9][cH:10][cH:11][cH:12]2)[o:6]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 1140TolueneHCID 8082PiperidineHCID 83223Diisopropyl malonateHCID 107571064-[2-(5-Methyl-2-phenyloxazol-4-yl)ethoxy]benzaldehyde

Product 1

HCID 22013889HCID 22013889, compound

Sources & evidence

ORD record
ord-89bae1e029bd444e8afd3b1553571b50
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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