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

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

Systemtic Name:1-[(4-ethylphenyl)-[4-(trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid
Openeye Name:1-[(4-ethylphenyl)-[4-(trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid
CAS Name:1-[(4-ethylphenyl)-[4-(trifluoromethyl)phenyl]methyl]-3-piperidinecarboxylic acid
IUPAC Name:1-[(4-ethylphenyl)-[4-(trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid
Traditional Name:1-[(4-ethylphenyl)-[4-(trifluoromethyl)phenyl]methyl]nipecotic acid
Formula: C22H24F3NO2
MolecularWeight: 391.42667
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC=C(C=C2)C(F)(F)F)N3CCCC(C3)C(=O)O


Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CC=C(C=C2)C(F)(F)F)N3CCCC(C3)C(=O)O


InChI

InChI=1S/C22H24F3NO2/c1-2-15-5-7-16(8-6-15)20(26-13-3-4-18(14-26)21(27)28)17-9-11-19(12-10-17)22(23,24)25/h5-12,18,20H,2-4,13-14H2,1H3,(H,27,28)


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