1-(1-phenethylpiperidin-4-yl)-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium

Systemtic Name: 1-(1-phenethylpiperidin-4-yl)-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium Openeye Name: 1-(1-phenethyl-4-piperidyl)-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium CAS Name: 1-(1-phenethyl-4-piperidinyl)-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium IUPAC Name: 1-(1-phenethylpiperidin-4-yl)-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium Traditional Name: 1-(1-phenethyl-4-piperidyl)-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium Formula: C24H31F3N3+ MolecularWeight: 418.51825

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1[NH+]2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F)CCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1[NH+]2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F)CCC4=CC=CC=C4

InChI

InChI=1S/C24H30F3N3/c25-24(26,27)21-7-4-8-23(19-21)30-17-15-29(16-18-30)22-10-13-28(14-11-22)12-9-20-5-2-1-3-6-20/h1-8,19,22H,9-18H2/p+1