1-[3-(3-fluorophenyl)propyl]-4-(3-methylpyridin-1-ium-4-yl)piperazin-1-ium

Systemtic Name: 1-[3-(3-fluorophenyl)propyl]-4-(3-methylpyridin-1-ium-4-yl)piperazin-1-ium Openeye Name: 1-[3-(3-fluorophenyl)propyl]-4-(3-methylpyridin-1-ium-4-yl)piperazin-1-ium CAS Name: 1-[3-(3-fluorophenyl)propyl]-4-(3-methyl-4-pyridin-1-iumyl)piperazin-1-ium IUPAC Name: 1-[3-(3-fluorophenyl)propyl]-4-(3-methylpyridin-1-ium-4-yl)piperazin-1-ium Traditional Name: 1-[3-(3-fluorophenyl)propyl]-4-(3-methylpyridin-1-ium-4-yl)piperazin-1-ium Formula: C19H26FN3+2 MolecularWeight: 315.428243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C[NH+]=C1)N2CC[NH+](CC2)CCCC3=CC(=CC=C3)F

Isomeric SMILES

CC1=C(C=C[NH+]=C1)N2CC[NH+](CC2)CCCC3=CC(=CC=C3)F

InChI

InChI=1S/C19H24FN3/c1-16-15-21-8-7-19(16)23-12-10-22(11-13-23)9-3-5-17-4-2-6-18(20)14-17/h2,4,6-8,14-15H,3,5,9-13H2,1H3/p+2