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

Systemtic Name: [1-[2-(3-fluorophenyl)ethyl]piperidin-1-ium-4-yl]methyl-methyl-(1-propan-2-ylpiperidin-1-ium-4-yl)azanium Openeye Name: [1-[2-(3-fluorophenyl)ethyl]piperidin-1-ium-4-yl]methyl-(1-isopropylpiperidin-1-ium-4-yl)-methyl-ammonium CAS Name: [1-[2-(3-fluorophenyl)ethyl]-4-piperidin-1-iumyl]methyl-methyl-(1-propan-2-yl-4-piperidin-1-iumyl)ammonium IUPAC Name: [1-[2-(3-fluorophenyl)ethyl]piperidin-1-ium-4-yl]methyl-methyl-(1-propan-2-ylpiperidin-1-ium-4-yl)azanium Traditional Name: [1-[2-(3-fluorophenyl)ethyl]piperidin-1-ium-4-yl]methyl-(1-isopropylpiperidin-1-ium-4-yl)-methyl-ammonium Formula: C23H41FN3+3 MolecularWeight: 378.590143

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)[NH+](C)CC2CC[NH+](CC2)CCC3=CC(=CC=C3)F

Isomeric SMILES

CC(C)[NH+]1CCC(CC1)[NH+](C)CC2CC[NH+](CC2)CCC3=CC(=CC=C3)F

InChI

InChI=1S/C23H38FN3/c1-19(2)27-15-10-23(11-16-27)25(3)18-21-8-13-26(14-9-21)12-7-20-5-4-6-22(24)17-20/h4-6,17,19,21,23H,7-16,18H2,1-3H3/p+3