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

Systemtic Name: 4-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]benzoic acid Openeye Name: 4-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]benzoic acid CAS Name: 4-[[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]methyl]benzoic acid IUPAC Name: 4-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]benzoic acid Traditional Name: 4-[[4-[3-(trifluoromethyl)phenyl]piperazino]methyl]benzoic acid Formula: C19H19F3N2O2 MolecularWeight: 364.36157

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C(=O)O)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C(=O)O)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C19H19F3N2O2/c20-19(21,22)16-2-1-3-17(12-16)24-10-8-23(9-11-24)13-14-4-6-15(7-5-14)18(25)26/h1-7,12H,8-11,13H2,(H,25,26)