2-[4-[(2-fluorophenyl)methyl]piperazin-4-ium-1-yl]quinolin-1-ium

Systemtic Name: 2-[4-[(2-fluorophenyl)methyl]piperazin-4-ium-1-yl]quinolin-1-ium Openeye Name: 2-[4-[(2-fluorophenyl)methyl]piperazin-4-ium-1-yl]quinolin-1-ium CAS Name: 2-[4-[(2-fluorophenyl)methyl]-1-piperazin-4-iumyl]quinolin-1-ium IUPAC Name: 2-[4-[(2-fluorophenyl)methyl]piperazin-4-ium-1-yl]quinolin-1-ium Traditional Name: 2-[4-(2-fluorobenzyl)piperazin-4-ium-1-yl]quinolin-1-ium Formula: C20H22FN3+2 MolecularWeight: 323.407183

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2F)C3=[NH+]C4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2F)C3=[NH+]C4=CC=CC=C4C=C3

InChI

InChI=1S/C20H20FN3/c21-18-7-3-1-6-17(18)15-23-11-13-24(14-12-23)20-10-9-16-5-2-4-8-19(16)22-20/h1-10H,11-15H2/p+2