4-(4-methylpiperidin-1-yl)-3-(phenylsulfonyl)quinolin-1-ium

Systemtic Name: 4-(4-methylpiperidin-1-yl)-3-(phenylsulfonyl)quinolin-1-ium Openeye Name: 3-(benzenesulfonyl)-4-(4-methyl-1-piperidyl)quinolin-1-ium CAS Name: 3-(benzenesulfonyl)-4-(4-methyl-1-piperidinyl)quinolin-1-ium IUPAC Name: 3-(benzenesulfonyl)-4-(4-methylpiperidin-1-yl)quinolin-1-ium Traditional Name: 3-besyl-4-(4-methylpiperidino)quinolin-1-ium Formula: C21H23N2O2S+ MolecularWeight: 367.48452

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=[NH+]C3=CC=CC=C32)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1CCN(CC1)C2=C(C=[NH+]C3=CC=CC=C32)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H22N2O2S/c1-16-11-13-23(14-12-16)21-18-9-5-6-10-19(18)22-15-20(21)26(24,25)17-7-3-2-4-8-17/h2-10,15-16H,11-14H2,1H3/p+1