6-fluoranyl-3-(4-methylphenyl)sulfonyl-4-(4-methylpiperidin-1-yl)quinolin-1-ium

Systemtic Name: 6-fluoranyl-3-(4-methylphenyl)sulfonyl-4-(4-methylpiperidin-1-yl)quinolin-1-ium Openeye Name: 6-fluoro-4-(4-methyl-1-piperidyl)-3-(p-tolylsulfonyl)quinolin-1-ium CAS Name: 6-fluoro-3-(4-methylphenyl)sulfonyl-4-(4-methyl-1-piperidinyl)quinolin-1-ium IUPAC Name: 6-fluoro-3-(4-methylphenyl)sulfonyl-4-(4-methylpiperidin-1-yl)quinolin-1-ium Traditional Name: 6-fluoro-4-(4-methylpiperidino)-3-tosyl-quinolin-1-ium Formula: C22H24FN2O2S+ MolecularWeight: 399.501563

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C3C=C(C=CC3=[NH+]C=C2S(=O)(=O)C4=CC=C(C=C4)C)F

Isomeric SMILES

CC1CCN(CC1)C2=C3C=C(C=CC3=[NH+]C=C2S(=O)(=O)C4=CC=C(C=C4)C)F

InChI

InChI=1S/C22H23FN2O2S/c1-15-3-6-18(7-4-15)28(26,27)21-14-24-20-8-5-17(23)13-19(20)22(21)25-11-9-16(2)10-12-25/h3-8,13-14,16H,9-12H2,1-2H3/p+1