Hydrochloric Acid → Hydrochloric Acid

HRID 2324786Notes

Reaction equation

HRID 2324786 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[NH:11][CH2:12][C:13]1([C:26]([NH:27][c:28]2[cH:29][c:30]([O:34][C:35]([N:36]([CH3:37])[CH3:38])=[O:39])[cH:31][cH:32][cH:33]2)=[O:40])[CH2:14][CH2:15][N:16]([C:19]([O:20][C:21]([CH3:22])([CH3:23])[CH3:24])=[O:25])[CH2:17][CH2:18]1.[CH3:48][OH:49].[ClH:41].[O:42]1[CH2:43][CH2:44][O:45][CH2:46][CH2:47]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[NH:11][CH2:12][C:13]1([C:26]([NH:27][c:28]2[cH:29][c:30]([O:34][C:35]([N:36]([CH3:37])[CH3:38])=[O:39])[cH:31][cH:32][cH:33]2)=[O:40])[CH2:14][CH2:15][NH:16][CH2:17][CH2:18]1.[ClH:41]

Participants

6

Reactant 4

HCID 313Hydrochloric AcidHCID 887MethanolHCID 312751,4-DioxaneHCID 68991379Tert-butyl 4-((benzyloxycarbonylamino)methyl)-4-(3-(dimethylcarbamoyloxy)phenylcarbamoyl)piperidine-1-carboxylate

Product 2

HCID 313Hydrochloric AcidHCID 670367573-(4-((Benzyloxycarbonylamino)methyl)piperidine-4-carboxamido)phenyl dimethylcarbamate

Sources & evidence

ORD record
ord-96e6d4232c3e411ca7b5b0b52abbc310
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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