1-[(3S)-1-cyclopentylpiperidin-1-ium-3-yl]-4-[3-(trifluoromethyl)phenyl]piperazine

Systemtic Name: 1-[(3S)-1-cyclopentylpiperidin-1-ium-3-yl]-4-[3-(trifluoromethyl)phenyl]piperazine Openeye Name: 1-[(3S)-1-cyclopentylpiperidin-1-ium-3-yl]-4-[3-(trifluoromethyl)phenyl]piperazine CAS Name: 1-[(3S)-1-cyclopentyl-3-piperidin-1-iumyl]-4-[3-(trifluoromethyl)phenyl]piperazine IUPAC Name: 1-[(3S)-1-cyclopentylpiperidin-1-ium-3-yl]-4-[3-(trifluoromethyl)phenyl]piperazine Traditional Name: 1-[(3S)-1-cyclopentylpiperidin-1-ium-3-yl]-4-[3-(trifluoromethyl)phenyl]piperazine Formula: C21H31F3N3+ MolecularWeight: 382.48615

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]2CCCC(C2)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1CCC(C1)[NH+]2CCC[C@@H](C2)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C21H30F3N3/c22-21(23,24)17-5-3-8-19(15-17)25-11-13-26(14-12-25)20-9-4-10-27(16-20)18-6-1-2-7-18/h3,5,8,15,18,20H,1-2,4,6-7,9-14,16H2/p+1/t20-/m0/s1