4-(4-methylpiperazin-4-ium-1-yl)-2-phenyl-8-(trifluoromethyl)quinolin-1-ium

Systemtic Name: 4-(4-methylpiperazin-4-ium-1-yl)-2-phenyl-8-(trifluoromethyl)quinolin-1-ium Openeye Name: 4-(4-methylpiperazin-4-ium-1-yl)-2-phenyl-8-(trifluoromethyl)quinolin-1-ium CAS Name: 4-(4-methyl-1-piperazin-4-iumyl)-2-phenyl-8-(trifluoromethyl)quinolin-1-ium IUPAC Name: 4-(4-methylpiperazin-4-ium-1-yl)-2-phenyl-8-(trifluoromethyl)quinolin-1-ium Traditional Name: 4-(4-methylpiperazin-4-ium-1-yl)-2-phenyl-8-(trifluoromethyl)quinolin-1-ium Formula: C21H22F3N3+2 MolecularWeight: 373.41469

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC(=[NH+]C3=C2C=CC=C3C(F)(F)F)C4=CC=CC=C4

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC(=[NH+]C3=C2C=CC=C3C(F)(F)F)C4=CC=CC=C4

InChI

InChI=1S/C21H20F3N3/c1-26-10-12-27(13-11-26)19-14-18(15-6-3-2-4-7-15)25-20-16(19)8-5-9-17(20)21(22,23)24/h2-9,14H,10-13H2,1H3/p+2