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

Systemtic Name: 6-methyl-3-(4-methylphenyl)sulfonyl-4-(4-methylpiperidin-1-yl)quinolin-1-ium Openeye Name: 6-methyl-4-(4-methyl-1-piperidyl)-3-(p-tolylsulfonyl)quinolin-1-ium CAS Name: 6-methyl-3-(4-methylphenyl)sulfonyl-4-(4-methyl-1-piperidinyl)quinolin-1-ium IUPAC Name: 6-methyl-3-(4-methylphenyl)sulfonyl-4-(4-methylpiperidin-1-yl)quinolin-1-ium Traditional Name: 6-methyl-4-(4-methylpiperidino)-3-tosyl-quinolin-1-ium Formula: C23H27N2O2S+ MolecularWeight: 395.53768

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C23H26N2O2S/c1-16-4-7-19(8-5-16)28(26,27)22-15-24-21-9-6-18(3)14-20(21)23(22)25-12-10-17(2)11-13-25/h4-9,14-15,17H,10-13H2,1-3H3/p+1