4-Chloro-3-(trifluoromethyl)benzoic acid → HCID 178473820, compound

HRID 2130529Notes

Reaction equation

HRID 2130529 reaction equation
[C:1]([CH3:2])(=[O:3])[N:4]1[CH2:5][CH2:6][CH:7]([C:10](=[O:11])[N:12]2[CH2:13][CH:14]([c:20]3[cH:21][c:22]([Cl:27])[c:23]([Cl:26])[cH:24][cH:25]3)[CH:15]([NH:18][CH3:19])[CH2:16][CH2:17]2)[CH2:8][CH2:9]1.[Cl:28][c:29]1[c:30]([C:38]([F:39])([F:40])[F:41])[cH:31][c:32]([C:33](=[O:34])[OH:35])[cH:36][cH:37]1>>[C:1]([CH3:2])(=[O:3])[N:4]1[CH2:5][CH2:6][CH:7]([C:10](=[O:11])[N:12]2[CH2:13][CH:14]([c:20]3[cH:21][c:22]([Cl:27])[c:23]([Cl:26])[cH:24][cH:25]3)[CH:15]([N:18]([CH3:19])[C:33]([c:32]3[cH:31][c:30]([C:38]([F:39])([F:40])[F:41])[c:29]([Cl:28])[cH:37][cH:36]3)=[O:35])[CH2:16][CH2:17]2)[CH2:8][CH2:9]1

Participants

3

Reactant 2

HCID 27738574-Chloro-3-(trifluoromethyl)benzoic acidHCID 689300921-[4-[3-(3,4-Dichlorophenyl)-4-(methylamino)piperidine-1-carbonyl]piperidin-1-yl]ethanone

Product 1

HCID 178473820HCID 178473820, compound

Sources & evidence

ORD record
ord-ae80e53f0fed47c7886c8204d8693638
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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