6-methyl-4-piperazin-4-ium-1-yl-2-(trifluoromethyl)quinolin-1-ium

Systemtic Name: 6-methyl-4-piperazin-4-ium-1-yl-2-(trifluoromethyl)quinolin-1-ium Openeye Name: 6-methyl-4-piperazin-4-ium-1-yl-2-(trifluoromethyl)quinolin-1-ium CAS Name: 6-methyl-4-(1-piperazin-4-iumyl)-2-(trifluoromethyl)quinolin-1-ium IUPAC Name: 6-methyl-4-piperazin-4-ium-1-yl-2-(trifluoromethyl)quinolin-1-ium Traditional Name: 6-methyl-4-piperazin-4-ium-1-yl-2-(trifluoromethyl)quinolin-1-ium Formula: C15H18F3N3+2 MolecularWeight: 297.31873

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)[NH+]=C(C=C2N3CC[NH2+]CC3)C(F)(F)F

Isomeric SMILES

CC1=CC2=C(C=C1)[NH+]=C(C=C2N3CC[NH2+]CC3)C(F)(F)F

InChI

InChI=1S/C15H16F3N3/c1-10-2-3-12-11(8-10)13(21-6-4-19-5-7-21)9-14(20-12)15(16,17)18/h2-3,8-9,19H,4-7H2,1H3/p+2