2-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]acetic acid CAS Name: 2-[4-[[3-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]acetic acid Traditional Name: 2-[4-[3-(trifluoromethyl)benzyl]piperazino]acetic acid Formula: C14H17F3N2O2 MolecularWeight: 302.29219

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=CC=C2)C(F)(F)F)CC(=O)O

Isomeric SMILES

C1CN(CCN1CC2=CC(=CC=C2)C(F)(F)F)CC(=O)O

InChI

InChI=1S/C14H17F3N2O2/c15-14(16,17)12-3-1-2-11(8-12)9-18-4-6-19(7-5-18)10-13(20)21/h1-3,8H,4-7,9-10H2,(H,20,21)