Hydrochloric Acid → (trans-4-{2-[4-(4-Chloro-benzoyl)-piperidin-1-yl]-ethyl}-cyclohexyl)-carbamic acid tert-butyl ester

HRID 666071

Reaction equation

HRID 666071 reaction equation
[C:17]([CH3:18])([CH3:19])([CH3:20])[O:21][C:22]([NH:23][CH:24]1[CH2:25][CH2:26][CH:27]([CH2:30][CH:31]=[O:32])[CH2:28][CH2:29]1)=[O:33].[Cl:2][c:3]1[cH:4][cH:5][c:6]([C:9](=[O:10])[CH:11]2[CH2:12][CH2:13][NH:14][CH2:15][CH2:16]2)[cH:7][cH:8]1.[ClH:1]>>[Cl:2][c:3]1[cH:4][cH:5][c:6]([C:9](=[O:10])[CH:11]2[CH2:12][CH2:13][N:14]([CH2:31][CH2:30][CH:27]3[CH2:26][CH2:25][CH:24]([NH:23][C:22]([O:21][C:17]([CH3:18])([CH3:19])[CH3:20])=[O:33])[CH2:29][CH2:28]3)[CH2:15][CH2:16]2)[cH:7][cH:8]1

Participants

4

Reactant 3

HCID 313Hydrochloric AcidHCID 27771154-(4-Chlorobenzoyl)PiperidineHCID 24720884Tert-butyl trans-4-(2-oxoethyl)cyclohexylcarbamate

Product 1

HCID 66628116(trans-4-{2-[4-(4-Chloro-benzoyl)-piperidin-1-yl]-ethyl}-cyclohexyl)-carbamic acid tert-butyl ester

Sources & evidence

ORD record
ord-178d11c7bb2d475d95c6e219277edd62
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Linked notes

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