6-fluoranyl-4-piperazin-4-ium-1-yl-quinolin-1-ium

Systemtic Name: 6-fluoranyl-4-piperazin-4-ium-1-yl-quinolin-1-ium Openeye Name: 6-fluoro-4-piperazin-4-ium-1-yl-quinolin-1-ium CAS Name: 6-fluoro-4-(1-piperazin-4-iumyl)quinolin-1-ium IUPAC Name: 6-fluoro-4-piperazin-4-ium-1-ylquinolin-1-ium Traditional Name: 6-fluoro-4-piperazin-4-ium-1-yl-quinolin-1-ium Formula: C13H16FN3+2 MolecularWeight: 233.284643

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=C3C=C(C=CC3=[NH+]C=C2)F

Isomeric SMILES

C1CN(CC[NH2+]1)C2=C3C=C(C=CC3=[NH+]C=C2)F

InChI

InChI=1S/C13H14FN3/c14-10-1-2-12-11(9-10)13(3-4-16-12)17-7-5-15-6-8-17/h1-4,9,15H,5-8H2/p+2