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Acetic Acid → Ethyl [(1-isopropyl-4,4,7-trimethyl-1,2,3,4-tetrahydroquinolin-6-yl)isobutylamino]benzoate

HRID 284591
Notes
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Reaction equation

HRID 284591 reaction equation
[C:34]([BH3-:35])#[N:36].[CH3:40][C:41](=[O:42])[OH:43].[CH3:44][C:45]#[N:46].[CH:1]([CH3:2])([CH3:3])[N:4]1[CH2:5][CH2:6][C:7]([CH3:27])([CH3:28])[c:8]2[cH:9][c:10]([NH:15][c:16]3[c:17]([C:18](=[O:19])[O:20][CH2:21][CH3:22])[cH:23][cH:24][cH:25][cH:26]3)[c:11]([CH3:14])[cH:12][c:13]21.[CH:29]([CH:30]([CH3:31])[CH3:32])=[O:33].[Na+:37].[Na+:39].[OH-:38]>>[CH:1]([CH3:2])([CH3:3])[N:4]1[CH2:5][CH2:6][C:7]([CH3:27])([CH3:28])[c:8]2[cH:9][c:10]([N:15]([c:16]3[c:17]([C:18](=[O:19])[O:20][CH2:21][CH3:22])[cH:23][cH:24][cH:25][cH:26]3)[CH2:29][CH:30]([CH3:31])[CH3:32])[c:11]([CH3:14])[cH:12][c:13]21
ParticipantsSources & evidenceReaction notes

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 923Sodium Ion2×HCID 961HydroxideHCID 6342AcetonitrileHCID 6561IsobutyraldehydeHCID 498716Cyano-borohydrideHCID 86755923Ethyl [(1-isopropyl-4,4,7-trimethyl-1,2,3,4-tetrahydroquinolin-6-yl)amino)benzoate

Product 1

HCID 53918247Ethyl [(1-isopropyl-4,4,7-trimethyl-1,2,3,4-tetrahydroquinolin-6-yl)isobutylamino]benzoate

Sources & evidence

ORD record
ord-d4fee186bf874cf081891e86369aab93
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes