Toluene → 6-[Ethyl-(5,5,8-trimethyl-5,6-dihydro-naphthalen-2-yl)-amino]-nicotinic acid

HRID 192830

Reaction equation

HRID 192830 reaction equation
[CH2:1]([CH3:2])[NH:3][c:4]1[cH:5][c:6]2[c:11]([cH:12][cH:13]1)[C:10]([CH3:14])([CH3:15])[CH2:9][CH:8]=[C:7]2[CH3:16].[CH3:27][c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1.[F:17][c:18]1[n:19][cH:20][c:21]([C:22](=[O:23])[OH:24])[cH:25][cH:26]1>>[CH2:1]([CH3:2])[N:3]([c:4]1[cH:5][c:6]2[c:11]([cH:12][cH:13]1)[C:10]([CH3:14])([CH3:15])[CH2:9][CH:8]=[C:7]2[CH3:16])[c:18]1[n:19][cH:20][c:21]([C:22](=[O:23])[OH:24])[cH:25][cH:26]1

Participants

4

Reactant 3

HCID 1140TolueneHCID 2428196-Fluoronicotinic AcidHCID 22218216HCID 22218216, compound

Product 1

HCID 101318656-[Ethyl-(5,5,8-trimethyl-5,6-dihydro-naphthalen-2-yl)-amino]-nicotinic acid

Sources & evidence

ORD record
ord-515024fa1b6f4850947599bf4dd06200
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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