3-(4-chlorophenyl)sulfonyl-6-fluoranyl-4-(4-methylpiperazin-4-ium-1-yl)quinolin-1-ium

Systemtic Name: 3-(4-chlorophenyl)sulfonyl-6-fluoranyl-4-(4-methylpiperazin-4-ium-1-yl)quinolin-1-ium Openeye Name: 3-(4-chlorophenyl)sulfonyl-6-fluoro-4-(4-methylpiperazin-4-ium-1-yl)quinolin-1-ium CAS Name: 3-(4-chlorophenyl)sulfonyl-6-fluoro-4-(4-methyl-1-piperazin-4-iumyl)quinolin-1-ium IUPAC Name: 3-(4-chlorophenyl)sulfonyl-6-fluoro-4-(4-methylpiperazin-4-ium-1-yl)quinolin-1-ium Traditional Name: 3-(4-chlorophenyl)sulfonyl-6-fluoro-4-(4-methylpiperazin-4-ium-1-yl)quinolin-1-ium Formula: C20H21ClFN3O2S+2 MolecularWeight: 421.916043

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C3C=C(C=CC3=[NH+]C=C2S(=O)(=O)C4=CC=C(C=C4)Cl)F

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C3C=C(C=CC3=[NH+]C=C2S(=O)(=O)C4=CC=C(C=C4)Cl)F

InChI

InChI=1S/C20H19ClFN3O2S/c1-24-8-10-25(11-9-24)20-17-12-15(22)4-7-18(17)23-13-19(20)28(26,27)16-5-2-14(21)3-6-16/h2-7,12-13H,8-11H2,1H3/p+2