phenethyl-(pyridin-4-ylmethyl)-[[3-(trifluoromethyl)phenyl]methyl]azanium

Systemtic Name: phenethyl-(pyridin-4-ylmethyl)-[[3-(trifluoromethyl)phenyl]methyl]azanium Openeye Name: phenethyl-(4-pyridylmethyl)-[[3-(trifluoromethyl)phenyl]methyl]ammonium CAS Name: phenethyl-(pyridin-4-ylmethyl)-[[3-(trifluoromethyl)phenyl]methyl]ammonium IUPAC Name: phenethyl-(pyridin-4-ylmethyl)-[[3-(trifluoromethyl)phenyl]methyl]azanium Traditional Name: phenethyl-(4-pyridylmethyl)-[3-(trifluoromethyl)benzyl]ammonium Formula: C22H22F3N2+ MolecularWeight: 371.41869

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC[NH+](CC2=CC=NC=C2)CC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CC[NH+](CC2=CC=NC=C2)CC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C22H21F3N2/c23-22(24,25)21-8-4-7-20(15-21)17-27(16-19-9-12-26-13-10-19)14-11-18-5-2-1-3-6-18/h1-10,12-13,15H,11,14,16-17H2/p+1