1-[(4-ethylphenyl)methyl]-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium

Systemtic Name: 1-[(4-ethylphenyl)methyl]-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium Openeye Name: 1-[(4-ethylphenyl)methyl]-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium CAS Name: 1-[(4-ethylphenyl)methyl]-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium IUPAC Name: 1-[(4-ethylphenyl)methyl]-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium Traditional Name: 1-(4-ethylbenzyl)-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium Formula: C20H24F3N2+ MolecularWeight: 349.41317

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C[NH+]2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CCC1=CC=C(C=C1)C[NH+]2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C20H23F3N2/c1-2-16-6-8-17(9-7-16)15-24-10-12-25(13-11-24)19-5-3-4-18(14-19)20(21,22)23/h3-9,14H,2,10-13,15H2,1H3/p+1