Hydrochloric Acid → 3-[3-(1-Benzyloxycarbonyl-1-methyl-ethoxy)-phenyl]-piperidine-1-carboxylic acid 4-isopropyl-benzyl ester

HRID 288387

Reaction equation

HRID 288387 reaction equation
[C:12](=[O:13])([n:14]1[cH:15][cH:16][n:17][cH:18]1)[n:19]1[cH:20][cH:21][n:22][cH:23]1.[CH2:24]([c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1)[O:31][C:32]([C:33]([CH3:34])([O:35][c:36]1[cH:37][c:38]([CH:42]2[CH2:43][NH:44][CH2:45][CH2:46][CH2:47]2)[cH:39][cH:40][cH:41]1)[CH3:48])=[O:49].[CH3:51][c:52]1[cH:53][cH:54][cH:55][cH:56][cH:57]1.[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][cH:6][c:7]([CH2:8][OH:9])[cH:10][cH:11]1.[ClH:50].[OH2:58]>>[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][cH:6][c:7]([CH2:8][O:9][C:12](=[O:13])[N:44]2[CH2:43][CH:42]([c:38]3[cH:37][c:36]([O:35][C:33]([C:32]([O:31][CH2:24][c:25]4[cH:26][cH:27][cH:28][cH:29][cH:30]4)=[O:49])([CH3:34])[CH3:48])[cH:41][cH:40][cH:39]3)[CH2:47][CH2:46][CH2:45]2)[cH:10][cH:11]1

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 325CuminolHCID 962WaterHCID 1140TolueneHCID 682631,1'-CarbonyldiimidazoleHCID 688839562-Methyl-2-(3-piperidin-3-yl-phenoxy)-propionic acid benzyl ester

Product 1

HCID 688826363-[3-(1-Benzyloxycarbonyl-1-methyl-ethoxy)-phenyl]-piperidine-1-carboxylic acid 4-isopropyl-benzyl ester

Sources & evidence

ORD record
ord-c68da98ea9484f6e8b36f343426499dd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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