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1-[quinolin-3-yl-[2-(trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid

1-[quinolin-3-yl-[2-(trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid

Systemtic Name:1-[quinolin-3-yl-[2-(trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid
Openeye Name:1-[3-quinolyl-[2-(trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid
CAS Name:1-[3-quinolinyl-[2-(trifluoromethyl)phenyl]methyl]-3-piperidinecarboxylic acid
IUPAC Name:1-[quinolin-3-yl-[2-(trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid
Traditional Name:1-[3-quinolyl-[2-(trifluoromethyl)phenyl]methyl]nipecotic acid
Formula: C23H21F3N2O2
MolecularWeight: 414.42025
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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(C2=CC=CC=C2C(F)(F)F)C3=CC4=CC=CC=C4N=C3)C(=O)O


Isomeric SMILES

C1CC(CN(C1)C(C2=CC=CC=C2C(F)(F)F)C3=CC4=CC=CC=C4N=C3)C(=O)O


InChI

InChI=1S/C23H21F3N2O2/c24-23(25,26)19-9-3-2-8-18(19)21(28-11-5-7-16(14-28)22(29)30)17-12-15-6-1-4-10-20(15)27-13-17/h1-4,6,8-10,12-13,16,21H,5,7,11,14H2,(H,29,30)


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