[1-[2-(3-fluorophenyl)ethyl]piperidin-1-ium-4-yl]methyl-methyl-(quinolin-2-ylmethyl)azanium

Systemtic Name: [1-[2-(3-fluorophenyl)ethyl]piperidin-1-ium-4-yl]methyl-methyl-(quinolin-2-ylmethyl)azanium Openeye Name: [1-[2-(3-fluorophenyl)ethyl]piperidin-1-ium-4-yl]methyl-methyl-(2-quinolylmethyl)ammonium CAS Name: [1-[2-(3-fluorophenyl)ethyl]-4-piperidin-1-iumyl]methyl-methyl-(2-quinolinylmethyl)ammonium IUPAC Name: [1-[2-(3-fluorophenyl)ethyl]piperidin-1-ium-4-yl]methyl-methyl-(quinolin-2-ylmethyl)azanium Traditional Name: [1-[2-(3-fluorophenyl)ethyl]piperidin-1-ium-4-yl]methyl-methyl-(2-quinolylmethyl)ammonium Formula: C25H32FN3+2 MolecularWeight: 393.540083

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1CC[NH+](CC1)CCC2=CC(=CC=C2)F)CC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

C[NH+](CC1CC[NH+](CC1)CCC2=CC(=CC=C2)F)CC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H30FN3/c1-28(19-24-10-9-22-6-2-3-8-25(22)27-24)18-21-12-15-29(16-13-21)14-11-20-5-4-7-23(26)17-20/h2-10,17,21H,11-16,18-19H2,1H3/p+2