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1-[(3-methylphenyl)-[3-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylic acid

1-[(3-methylphenyl)-[3-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylic acid

Systemtic Name:1-[(3-methylphenyl)-[3-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylic acid
Openeye Name:1-[m-tolyl-[3-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylic acid
CAS Name:1-[(3-methylphenyl)-[3-(trifluoromethyl)phenyl]methyl]-4-piperidinecarboxylic acid
IUPAC Name:1-[(3-methylphenyl)-[3-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylic acid
Traditional Name:1-[m-tolyl-[3-(trifluoromethyl)phenyl]methyl]isonipecotic acid
Formula: C21H22F3NO2
MolecularWeight: 377.40009
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C2=CC(=CC=C2)C(F)(F)F)N3CCC(CC3)C(=O)O


Isomeric SMILES

CC1=CC(=CC=C1)C(C2=CC(=CC=C2)C(F)(F)F)N3CCC(CC3)C(=O)O


InChI

InChI=1S/C21H22F3NO2/c1-14-4-2-5-16(12-14)19(25-10-8-15(9-11-25)20(26)27)17-6-3-7-18(13-17)21(22,23)24/h2-7,12-13,15,19H,8-11H2,1H3,(H,26,27)


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