Acetic Acid → HCID 67314690, compound

HRID 1200343Notes

Reaction equation

HRID 1200343 reaction equation
[C:30]([OH:31])(=[O:32])[CH3:33].[CH3:34][CH2:35][N:36]([CH2:37][CH3:38])[CH2:39][CH3:40].[F:1][c:2]1[cH:3][c:4]2[c:8]([cH:9][cH:10]1)[NH:7][C:6](=[O:11])[C:5]2=[C:12]1[O:13][CH2:14][c:15]2[n:16][c:17]([CH:21]=[CH2:22])[cH:18][cH:19][c:20]21.[O:41]1[CH2:42][CH2:43][O:44][CH2:45][CH2:46]1.[OH:23][CH:24]1[CH2:25][CH2:26][NH:27][CH2:28][CH2:29]1>>[F:1][c:2]1[cH:3][c:4]2[c:8]([cH:9][cH:10]1)[NH:7][C:6](=[O:11])[C:5]2=[C:12]1[O:13][CH2:14][c:15]2[n:16][c:17]([CH2:21][CH2:22][N:27]3[CH2:26][CH2:25][CH:24]([OH:23])[CH2:29][CH2:28]3)[cH:18][cH:19][c:20]21

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 8471TriethylamineHCID 312751,4-DioxaneHCID 79341Piperidin-4-olHCID 67314553HCID 67314553, compound

Product 1

HCID 67314690HCID 67314690, compound

Sources & evidence

ORD record
ord-bbdea747d6f040f19deed3de46f374c7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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