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

Systemtic Name: 1-[(3-methylphenyl)methyl]-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium Openeye Name: 1-(m-tolylmethyl)-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium CAS Name: 1-[(3-methylphenyl)methyl]-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium IUPAC Name: 1-[(3-methylphenyl)methyl]-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium Traditional Name: 1-(3-methylbenzyl)-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium Formula: C19H22F3N2+ MolecularWeight: 335.38659

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C[NH+]2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CC1=CC(=CC=C1)C[NH+]2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C19H21F3N2/c1-15-4-2-5-16(12-15)14-23-8-10-24(11-9-23)18-7-3-6-17(13-18)19(20,21)22/h2-7,12-13H,8-11,14H2,1H3/p+1