Chloride → tert-Butyl-1-[3-(4-octylphenoxy)-2-oxopropyl]pyrrole-2-carboxylate

HRID 89328Notes

Reaction equation

HRID 89328 reaction equation
[C:39](=[O:40])([O-:41])[OH:42].[C:8]([CH3:9])([CH3:10])([CH3:11])[O:12][C:13](=[O:14])[c:15]1[n:16]([CH2:20][CH:21]([CH2:22][O:23][c:24]2[cH:25][cH:26][c:27]([CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH3:37])[cH:28][cH:29]2)[OH:38])[cH:17][cH:18][cH:19]1.[CH3:1][C:2]([O:3][C:4](=[O:5])[CH3:6])=[O:7].[CH3:46][S:47]([CH3:48])=[O:49].[Cl-:44].[Na+:43].[Na+:45]>>[C:8]([CH3:9])([CH3:10])([CH3:11])[O:12][C:13](=[O:14])[c:15]1[n:16]([CH2:20][C:21]([CH2:22][O:23][c:24]2[cH:25][cH:26][c:27]([CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH3:37])[cH:28][cH:29]2)=[O:38])[cH:17][cH:18][cH:19]1

Participants

7

Reactant 6

HCID 312ChlorideHCID 679Dimethyl SulfoxideHCID 769Bicarbonate IonHCID 923Sodium ion2×HCID 7918Acetic AnhydrideHCID 12992896HCID 12992896, compound

Product 1

HCID 12992897tert-Butyl-1-[3-(4-octylphenoxy)-2-oxopropyl]pyrrole-2-carboxylate

Sources & evidence

ORD record
ord-9ef783c93cf543308a7b06e5a5e76192
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

Loading…