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

Systemtic Name: 3-(4-chlorophenyl)sulfonyl-6-methyl-4-(4-methylpiperazin-4-ium-1-yl)quinolin-1-ium Openeye Name: 3-(4-chlorophenyl)sulfonyl-6-methyl-4-(4-methylpiperazin-4-ium-1-yl)quinolin-1-ium CAS Name: 3-(4-chlorophenyl)sulfonyl-6-methyl-4-(4-methyl-1-piperazin-4-iumyl)quinolin-1-ium IUPAC Name: 3-(4-chlorophenyl)sulfonyl-6-methyl-4-(4-methylpiperazin-4-ium-1-yl)quinolin-1-ium Traditional Name: 3-(4-chlorophenyl)sulfonyl-6-methyl-4-(4-methylpiperazin-4-ium-1-yl)quinolin-1-ium Formula: C21H24ClN3O2S+2 MolecularWeight: 417.95216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C[NH+]=C2C=C1)S(=O)(=O)C3=CC=C(C=C3)Cl)N4CC[NH+](CC4)C

Isomeric SMILES

CC1=CC2=C(C(=C[NH+]=C2C=C1)S(=O)(=O)C3=CC=C(C=C3)Cl)N4CC[NH+](CC4)C

InChI

InChI=1S/C21H22ClN3O2S/c1-15-3-8-19-18(13-15)21(25-11-9-24(2)10-12-25)20(14-23-19)28(26,27)17-6-4-16(22)5-7-17/h3-8,13-14H,9-12H2,1-2H3/p+2