4-[(2,4-dimethyl-6-propan-2-yl-pyridin-1-ium-1-yl)methyl]benzenesulfonamide

Systemtic Name: 4-[(2,4-dimethyl-6-propan-2-yl-pyridin-1-ium-1-yl)methyl]benzenesulfonamide Openeye Name: 4-[(2-isopropyl-4,6-dimethyl-pyridin-1-ium-1-yl)methyl]benzenesulfonamide CAS Name: 4-[(2,4-dimethyl-6-propan-2-yl-1-pyridin-1-iumyl)methyl]benzenesulfonamide IUPAC Name: 4-[(2,4-dimethyl-6-propan-2-ylpyridin-1-ium-1-yl)methyl]benzenesulfonamide Traditional Name: 4-[(2-isopropyl-4,6-dimethyl-pyridin-1-ium-1-yl)methyl]benzenesulfonamide Formula: C17H23N2O2S+ MolecularWeight: 319.44172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+](C(=C1)C(C)C)CC2=CC=C(C=C2)S(=O)(=O)N)C

Isomeric SMILES

CC1=CC(=[N+](C(=C1)C(C)C)CC2=CC=C(C=C2)S(=O)(=O)N)C

InChI

InChI=1S/C17H23N2O2S/c1-12(2)17-10-13(3)9-14(4)19(17)11-15-5-7-16(8-6-15)22(18,20)21/h5-10,12H,11H2,1-4H3,(H2,18,20,21)/q+1