Hydrochloric Acid → Hydrochloric Acid

HRID 2154594Notes

Reaction equation

HRID 2154594 reaction equation
[C:45]([O:46][CH2:47][CH3:48])(=[O:49])[CH3:50].[CH3:52][CH2:53][O:54][C:55](=[O:56])[CH3:57].[ClH:51].[O:1]1[CH2:2][CH2:3][O:4][c:5]2[c:6]1[cH:7][cH:8][c:9]([CH2:11][N:12]([C:13](=[O:14])[O:15][C:16]([CH3:17])([CH3:18])[CH3:19])[CH:20]1[CH2:21][CH2:22][N:23]([CH2:26][CH2:27][n:28]3[c:29](=[O:44])[cH:30][cH:31][c:32]4[c:33]([C:40]([CH2:41][CH3:42])=[O:43])[cH:34][c:35]([O:38][CH3:39])[cH:36][c:37]34)[CH2:24][CH2:25]1)[cH:10]2>>[ClH:51].[O:1]1[CH2:2][CH2:3][O:4][c:5]2[c:6]1[cH:7][cH:8][c:9]([CH2:11][NH:12][CH:20]1[CH2:21][CH2:22][N:23]([CH2:26][CH2:27][n:28]3[c:29](=[O:44])[cH:30][cH:31][c:32]4[c:33]([C:40]([CH2:41][CH3:42])=[O:43])[cH:34][c:35]([O:38][CH3:39])[cH:36][c:37]34)[CH2:24][CH2:25]1)[cH:10]2

Participants

5

Reactant 3

HCID 313Hydrochloric AcidHCID 8857Ethyl Acetate2×HCID 59398377tert-butyl (2,3-dihydro-1,4-benzodioxin-6-ylmethyl)(1-(2-(7-methoxy-2-oxo-5-propionylquinolin-1(2H)-yl)ethyl)piperidin-4-yl)carbamate

Product 2

HCID 313Hydrochloric AcidHCID 593983361-[2-[4-(2,3-Dihydro-1,4-benzodioxin-6-ylmethylamino)piperidin-1-yl]ethyl]-7-methoxy-5-propanoylquinolin-2-one

Sources & evidence

ORD record
ord-fa5ae2c1ad03428784a9a250dc5f5855
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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