Methanol → 2-(3-(2-Chloro-4-fluorobenzamido)-4-fluorophenyl)-3,3-dimethyl-1,2,3,4-tetrahydroquinoline-6-carboxylic acid

HRID 1137522Notes

Reaction equation

HRID 1137522 reaction equation
[CH3:37][OH:38].[Cl:1][c:2]1[c:3]([C:4](=[O:5])[NH:6][c:7]2[cH:8][c:9]([CH:14]3[NH:15][c:16]4[cH:17][cH:18][c:19]([C:26](=[O:27])[O:28][CH3:29])[cH:20][c:21]4[CH2:22][C:23]3([CH3:24])[CH3:25])[cH:10][cH:11][c:12]2[F:13])[cH:30][cH:31][c:32]([F:34])[cH:33]1.[Na+:36].[OH-:35]>>[Cl:1][c:2]1[c:3]([C:4](=[O:5])[NH:6][c:7]2[cH:8][c:9]([CH:14]3[NH:15][c:16]4[cH:17][cH:18][c:19]([C:26](=[O:27])[OH:28])[cH:20][c:21]4[CH2:22][C:23]3([CH3:24])[CH3:25])[cH:10][cH:11][c:12]2[F:13])[cH:30][cH:31][c:32]([F:34])[cH:33]1

Participants

5

Reactant 4

HCID 887MethanolHCID 923Sodium ionHCID 961HydroxideHCID 67440538Methyl 2-(3-(2-chloro-4-fluorobenzamido)-4-fluorophenyl)-3,3-dimethyl-1,2,3,4-tetrahydroquinoline-6-carboxylate

Product 1

HCID 674407332-(3-(2-Chloro-4-fluorobenzamido)-4-fluorophenyl)-3,3-dimethyl-1,2,3,4-tetrahydroquinoline-6-carboxylic acid

Sources & evidence

ORD record
ord-08fddfe80f3440d5aa697b3d687e072f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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