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

Systemtic Name: [1-[2-(3-fluorophenyl)ethyl]piperidin-1-ium-4-yl]methyl-methyl-(pyridin-3-ylmethyl)azanium Openeye Name: [1-[2-(3-fluorophenyl)ethyl]piperidin-1-ium-4-yl]methyl-methyl-(3-pyridylmethyl)ammonium CAS Name: [1-[2-(3-fluorophenyl)ethyl]-4-piperidin-1-iumyl]methyl-methyl-(3-pyridinylmethyl)ammonium IUPAC Name: [1-[2-(3-fluorophenyl)ethyl]piperidin-1-ium-4-yl]methyl-methyl-(pyridin-3-ylmethyl)azanium Traditional Name: [1-[2-(3-fluorophenyl)ethyl]piperidin-1-ium-4-yl]methyl-methyl-(3-pyridylmethyl)ammonium Formula: C21H30FN3+2 MolecularWeight: 343.481403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28FN3/c1-24(17-20-5-3-10-23-15-20)16-19-8-12-25(13-9-19)11-7-18-4-2-6-21(22)14-18/h2-6,10,14-15,19H,7-9,11-13,16-17H2,1H3/p+2