Benzoic Acid → HCID 21082449, compound

HRID 2343358Notes

Reaction equation

HRID 2343358 reaction equation
[C:13]([CH2:14][C:15](=[O:16])[O:17][CH3:18])(=[O:19])[O:20][CH3:21].[CH2:22]1[CH2:23][CH2:24][NH:25][CH2:26][CH2:27]1.[CH3:1][O:2][c:3]1[c:4]([CH:5]=[O:6])[cH:7][cH:8][c:9]([O:11][CH3:12])[cH:10]1.[CH3:37][c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1.[OH:28][C:29]([c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1)=[O:36]>>[CH3:1][O:2][c:3]1[c:4]([CH:5]=[C:14]([C:13](=[O:19])[O:20][CH3:21])[C:15](=[O:16])[O:17][CH3:18])[cH:7][cH:8][c:9]([O:11][CH3:12])[cH:10]1

Participants

6

Reactant 5

HCID 243Benzoic AcidHCID 1140TolueneHCID 7943Dimethyl malonateHCID 8082PiperidineHCID 691752,4-Dimethoxybenzaldehyde

Product 1

HCID 21082449HCID 21082449, compound

Sources & evidence

ORD record
ord-f9883c73c18c4393907206d8b6b52f59
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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