1-[4-(4-fluoranylphenoxy)butyl]-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium

Systemtic Name: 1-[4-(4-fluoranylphenoxy)butyl]-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium Openeye Name: 1-[4-(4-fluorophenoxy)butyl]-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium CAS Name: 1-[4-(4-fluorophenoxy)butyl]-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium IUPAC Name: 1-[4-(4-fluorophenoxy)butyl]-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium Traditional Name: 1-[4-(4-fluorophenoxy)butyl]-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium Formula: C21H25F4N2O+ MolecularWeight: 397.429613

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCCOC2=CC=C(C=C2)F)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1CN(CC[NH+]1CCCCOC2=CC=C(C=C2)F)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C21H24F4N2O/c22-18-6-8-20(9-7-18)28-15-2-1-10-26-11-13-27(14-12-26)19-5-3-4-17(16-19)21(23,24)25/h3-9,16H,1-2,10-15H2/p+1