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

Systemtic Name: 4-[(2,4-diphenyl-6-propan-2-yl-pyridin-1-ium-1-yl)methyl]benzenesulfonamide Openeye Name: 4-[(2-isopropyl-4,6-diphenyl-pyridin-1-ium-1-yl)methyl]benzenesulfonamide CAS Name: 4-[(2,4-diphenyl-6-propan-2-yl-1-pyridin-1-iumyl)methyl]benzenesulfonamide IUPAC Name: 4-[(2,4-diphenyl-6-propan-2-ylpyridin-1-ium-1-yl)methyl]benzenesulfonamide Traditional Name: 4-[(2-isopropyl-4,6-diphenyl-pyridin-1-ium-1-yl)methyl]benzenesulfonamide Formula: C27H27N2O2S+ MolecularWeight: 443.58048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC(=[N+]1CC2=CC=C(C=C2)S(=O)(=O)N)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)C1=CC(=CC(=[N+]1CC2=CC=C(C=C2)S(=O)(=O)N)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H27N2O2S/c1-20(2)26-17-24(22-9-5-3-6-10-22)18-27(23-11-7-4-8-12-23)29(26)19-21-13-15-25(16-14-21)32(28,30)31/h3-18,20H,19H2,1-2H3,(H2,28,30,31)/q+1