Hydrochloric Acid → 2-Ethoxy-4-(2-((3-methyl-1-(2-(piperidin-1-yl)phenyl)butyl)amino)-2-oxoethyl)benzoic acid

HRID 2338999Notes

Reaction equation

HRID 2338999 reaction equation
[CH2:1]([CH3:2])[O:3][c:4]1[c:5]([C:6](=[O:7])[O:8][CH2:9][CH3:10])[cH:11][cH:12][c:13]([CH2:15][C:16](=[O:17])[NH:18][CH:19]([CH2:20][CH:21]([CH3:22])[CH3:23])[c:24]2[c:25]([N:30]3[CH2:31][CH2:32][CH2:33][CH2:34][CH2:35]3)[cH:26][cH:27][cH:28][cH:29]2)[cH:14]1.[CH3:39][CH2:40][OH:41].[ClH:38].[Na+:37].[OH-:36]>>[CH2:1]([CH3:2])[O:3][c:4]1[c:5]([C:6](=[O:7])[OH:8])[cH:11][cH:12][c:13]([CH2:15][C:16](=[O:17])[NH:18][CH:19]([CH2:20][CH:21]([CH3:22])[CH3:23])[c:24]2[c:25]([N:30]3[CH2:31][CH2:32][CH2:33][CH2:34][CH2:35]3)[cH:26][cH:27][cH:28][cH:29]2)[cH:14]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 13729227Ethyl 2-ethoxy-4-[N-(1-(2-piperidino-phenyl)-3-methyl-1-butyl)-aminocarbonylmethyl]benzoate

Product 1

HCID 45472-Ethoxy-4-(2-((3-methyl-1-(2-(piperidin-1-yl)phenyl)butyl)amino)-2-oxoethyl)benzoic acid

Sources & evidence

ORD record
ord-5c3e0198b9c043398935f99d1f23abc6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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