(3S)-3-pyrrolidin-1-yl-1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-1-ium

Systemtic Name: (3S)-3-pyrrolidin-1-yl-1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-1-ium Openeye Name: (3S)-3-pyrrolidin-1-yl-1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-1-ium CAS Name: (3S)-3-(1-pyrrolidinyl)-1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-1-ium IUPAC Name: (3S)-3-pyrrolidin-1-yl-1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-1-ium Traditional Name: (3S)-3-pyrrolidino-1-[3-(trifluoromethyl)benzyl]piperidin-1-ium Formula: C17H24F3N2+ MolecularWeight: 313.38107

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2CCC[NH+](C2)CC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1CCN(C1)[C@H]2CCC[NH+](C2)CC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C17H23F3N2/c18-17(19,20)15-6-3-5-14(11-15)12-21-8-4-7-16(13-21)22-9-1-2-10-22/h3,5-6,11,16H,1-2,4,7-10,12-13H2/p+1/t16-/m0/s1