6-fluoranyl-4-(4-methylpiperazin-4-ium-1-yl)-2-(trifluoromethyl)quinolin-1-ium

Systemtic Name: 6-fluoranyl-4-(4-methylpiperazin-4-ium-1-yl)-2-(trifluoromethyl)quinolin-1-ium Openeye Name: 6-fluoro-4-(4-methylpiperazin-4-ium-1-yl)-2-(trifluoromethyl)quinolin-1-ium CAS Name: 6-fluoro-4-(4-methyl-1-piperazin-4-iumyl)-2-(trifluoromethyl)quinolin-1-ium IUPAC Name: 6-fluoro-4-(4-methylpiperazin-4-ium-1-yl)-2-(trifluoromethyl)quinolin-1-ium Traditional Name: 6-fluoro-4-(4-methylpiperazin-4-ium-1-yl)-2-(trifluoromethyl)quinolin-1-ium Formula: C15H17F4N3+2 MolecularWeight: 315.309193

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC(=[NH+]C3=C2C=C(C=C3)F)C(F)(F)F

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC(=[NH+]C3=C2C=C(C=C3)F)C(F)(F)F

InChI

InChI=1S/C15H15F4N3/c1-21-4-6-22(7-5-21)13-9-14(15(17,18)19)20-12-3-2-10(16)8-11(12)13/h2-3,8-9H,4-7H2,1H3/p+2