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

Systemtic Name: 4-[2-(2,4-dimethyl-6-propan-2-yl-pyridin-1-ium-1-yl)ethyl]benzenesulfonamide Openeye Name: 4-[2-(2-isopropyl-4,6-dimethyl-pyridin-1-ium-1-yl)ethyl]benzenesulfonamide CAS Name: 4-[2-(2,4-dimethyl-6-propan-2-yl-1-pyridin-1-iumyl)ethyl]benzenesulfonamide IUPAC Name: 4-[2-(2,4-dimethyl-6-propan-2-ylpyridin-1-ium-1-yl)ethyl]benzenesulfonamide Traditional Name: 4-[2-(2-isopropyl-4,6-dimethyl-pyridin-1-ium-1-yl)ethyl]benzenesulfonamide Formula: C18H25N2O2S+ MolecularWeight: 333.4683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+](C(=C1)C(C)C)CCC2=CC=C(C=C2)S(=O)(=O)N)C

Isomeric SMILES

CC1=CC(=[N+](C(=C1)C(C)C)CCC2=CC=C(C=C2)S(=O)(=O)N)C

InChI

InChI=1S/C18H25N2O2S/c1-13(2)18-12-14(3)11-15(4)20(18)10-9-16-5-7-17(8-6-16)23(19,21)22/h5-8,11-13H,9-10H2,1-4H3,(H2,19,21,22)/q+1