N-(4,6-dimethylpyridin-1-ium-2-yl)-4-(2-methylpropyl)benzenesulfonamide

Systemtic Name: N-(4,6-dimethylpyridin-1-ium-2-yl)-4-(2-methylpropyl)benzenesulfonamide Openeye Name: N-(4,6-dimethylpyridin-1-ium-2-yl)-4-isobutyl-benzenesulfonamide CAS Name: N-(4,6-dimethyl-2-pyridin-1-iumyl)-4-(2-methylpropyl)benzenesulfonamide IUPAC Name: N-(4,6-dimethylpyridin-1-ium-2-yl)-4-(2-methylpropyl)benzenesulfonamide Traditional Name: N-(4,6-dimethylpyridin-1-ium-2-yl)-4-isobutyl-benzenesulfonamide Formula: C17H23N2O2S+ MolecularWeight: 319.44172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C(=C1)NS(=O)(=O)C2=CC=C(C=C2)CC(C)C)C

Isomeric SMILES

CC1=CC(=[NH+]C(=C1)NS(=O)(=O)C2=CC=C(C=C2)CC(C)C)C

InChI

InChI=1S/C17H22N2O2S/c1-12(2)9-15-5-7-16(8-6-15)22(20,21)19-17-11-13(3)10-14(4)18-17/h5-8,10-12H,9H2,1-4H3,(H,18,19)/p+1