4,6-dimethyl-3-(4-methylphenyl)sulfonyl-2-piperidin-1-yl-pyridin-1-ium

Systemtic Name: 4,6-dimethyl-3-(4-methylphenyl)sulfonyl-2-piperidin-1-yl-pyridin-1-ium Openeye Name: 4,6-dimethyl-2-(1-piperidyl)-3-(p-tolylsulfonyl)pyridin-1-ium CAS Name: 4,6-dimethyl-3-(4-methylphenyl)sulfonyl-2-(1-piperidinyl)pyridin-1-ium IUPAC Name: 4,6-dimethyl-3-(4-methylphenyl)sulfonyl-2-piperidin-1-ylpyridin-1-ium Traditional Name: 4,6-dimethyl-2-piperidino-3-tosyl-pyridin-1-ium Formula: C19H25N2O2S+ MolecularWeight: 345.479

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C([NH+]=C(C=C2C)C)N3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C([NH+]=C(C=C2C)C)N3CCCCC3

InChI

InChI=1S/C19H24N2O2S/c1-14-7-9-17(10-8-14)24(22,23)18-15(2)13-16(3)20-19(18)21-11-5-4-6-12-21/h7-10,13H,4-6,11-12H2,1-3H3/p+1