Hydrochloric Acid → HCID 58476251, compound

HRID 182580Notes

Reaction equation

[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[cH:7][c:8]2[c:13]([cH:14][cH:15]1)[NH:12][CH:11]([c:16]1[cH:17][c:18]([N:22]3[CH2:23][CH2:24][N:25]([c:28]4[c:29]([CH3:34])[cH:30][cH:31][cH:32][cH:33]4)[CH2:26][CH2:27]3)[cH:19][cH:20][cH:21]1)[C:10]([CH3:35])([CH3:36])[CH2:9]2.[CH3:40][OH:41].[ClH:39].[Na+:38].[O:42]1[CH2:43][CH2:44][CH2:45][CH2:46]1.[OH-:37].[OH2:47]>>[O:3]=[C:4]([OH:5])[c:6]1[cH:7][c:8]2[c:13]([cH:14][cH:15]1)[NH:12][CH:11]([c:16]1[cH:17][c:18]([N:22]3[CH2:23][CH2:24][N:25]([c:28]4[c:29]([CH3:34])[cH:30][cH:31][cH:32][cH:33]4)[CH2:26][CH2:27]3)[cH:19][cH:20][cH:21]1)[C:10]([CH3:35])([CH3:36])[CH2:9]2

Participants

Reactant 7

HCID 313Hydrochloric Acid

HCID 8028Tetrahydrofuran

HCID 674399813,3-Dimethyl-2-[3-(4-o-tolyl-piperazin-1-yl)-phenyl]-1,2,3,4-tetrahydro-quinoline-6-carboxylic acid ethyl ester

Product 1

HCID 58476251HCID 58476251, compound

Sources & evidence

ORD record: ord-553c9abab4d04beea81d776c5ea4cd60
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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