2-[4-[1-[(2-fluorophenyl)methyl]piperidin-1-ium-4-yl]piperazine-1,4-diium-1-yl]ethanol

Systemtic Name: 2-[4-[1-[(2-fluorophenyl)methyl]piperidin-1-ium-4-yl]piperazine-1,4-diium-1-yl]ethanol Openeye Name: 2-[4-[1-[(2-fluorophenyl)methyl]piperidin-1-ium-4-yl]piperazine-1,4-diium-1-yl]ethanol CAS Name: 2-[4-[1-[(2-fluorophenyl)methyl]-4-piperidin-1-iumyl]-1-piperazine-1,4-diiumyl]ethanol IUPAC Name: 2-[4-[1-[(2-fluorophenyl)methyl]piperidin-1-ium-4-yl]piperazine-1,4-diium-1-yl]ethanol Traditional Name: 2-[4-[1-(2-fluorobenzyl)piperidin-1-ium-4-yl]piperazine-1,4-diium-1-yl]ethanol Formula: C18H31FN3O+3 MolecularWeight: 324.456643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1[NH+]2CC[NH+](CC2)CCO)CC3=CC=CC=C3F

Isomeric SMILES

C1C[NH+](CCC1[NH+]2CC[NH+](CC2)CCO)CC3=CC=CC=C3F

InChI

InChI=1S/C18H28FN3O/c19-18-4-2-1-3-16(18)15-21-7-5-17(6-8-21)22-11-9-20(10-12-22)13-14-23/h1-4,17,23H,5-15H2/p+3