Tetrahydrofuran → 3-(4-Isobutoxy-piperidine-1-sulfonyl)-benzoic acid

HRID 1535215Notes

Reaction equation

HRID 1535215 reaction equation
[CH2:10]([CH:11]([CH3:12])[CH3:13])[O:14][CH:15]1[CH2:16][CH2:17][NH:18][CH2:19][CH2:20]1.[CH2:34]1[O:35][CH2:36][CH2:37][CH2:38]1.[CH:1]([N:2]([CH2:3][CH3:4])[CH:5]([CH3:6])[CH3:7])([CH3:8])[CH3:9].[Cl:21][S:22](=[O:23])(=[O:24])[c:25]1[cH:26][c:27]([C:28](=[O:29])[OH:30])[cH:31][cH:32][cH:33]1>>[CH2:10]([CH:11]([CH3:12])[CH3:13])[O:14][CH:15]1[CH2:16][CH2:17][N:18]([S:22](=[O:23])(=[O:24])[c:25]2[cH:26][c:27]([C:28](=[O:29])[OH:30])[cH:31][cH:32][cH:33]2)[CH2:19][CH2:20]1

Participants

5

Reactant 4

HCID 8028TetrahydrofuranHCID 77641Benzoic acid, 3-(chlorosulfonyl)-HCID 81531DiisopropylethylamineHCID 117011884-(2-Methylpropoxy)piperidine

Product 1

HCID 670866863-(4-Isobutoxy-piperidine-1-sulfonyl)-benzoic acid

Sources & evidence

ORD record
ord-04115cbc57794850b8394e8d1259d141
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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