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

Systemtic Name: 1-[(3S)-1-propylpiperidin-1-ium-3-yl]-4-[3-(trifluoromethyl)phenyl]piperazine Openeye Name: 1-[(3S)-1-propylpiperidin-1-ium-3-yl]-4-[3-(trifluoromethyl)phenyl]piperazine CAS Name: 1-[(3S)-1-propyl-3-piperidin-1-iumyl]-4-[3-(trifluoromethyl)phenyl]piperazine IUPAC Name: 1-[(3S)-1-propylpiperidin-1-ium-3-yl]-4-[3-(trifluoromethyl)phenyl]piperazine Traditional Name: 1-[(3S)-1-propylpiperidin-1-ium-3-yl]-4-[3-(trifluoromethyl)phenyl]piperazine Formula: C19H29F3N3+ MolecularWeight: 356.44887

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCCC(C1)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CCC[NH+]1CCC[C@@H](C1)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C19H28F3N3/c1-2-8-23-9-4-7-18(15-23)25-12-10-24(11-13-25)17-6-3-5-16(14-17)19(20,21)22/h3,5-6,14,18H,2,4,7-13,15H2,1H3/p+1/t18-/m0/s1