4-[(4-phenyl-2,6-dipropyl-pyridin-1-ium-1-yl)methyl]benzenesulfonamide

Systemtic Name: 4-[(4-phenyl-2,6-dipropyl-pyridin-1-ium-1-yl)methyl]benzenesulfonamide Openeye Name: 4-[(4-phenyl-2,6-dipropyl-pyridin-1-ium-1-yl)methyl]benzenesulfonamide CAS Name: 4-[(4-phenyl-2,6-dipropyl-1-pyridin-1-iumyl)methyl]benzenesulfonamide IUPAC Name: 4-[(4-phenyl-2,6-dipropylpyridin-1-ium-1-yl)methyl]benzenesulfonamide Traditional Name: 4-[(4-phenyl-2,6-dipropyl-pyridin-1-ium-1-yl)methyl]benzenesulfonamide Formula: C24H29N2O2S+ MolecularWeight: 409.56426

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=CC(=[N+]1CC2=CC=C(C=C2)S(=O)(=O)N)CCC)C3=CC=CC=C3

Isomeric SMILES

CCCC1=CC(=CC(=[N+]1CC2=CC=C(C=C2)S(=O)(=O)N)CCC)C3=CC=CC=C3

InChI

InChI=1S/C24H29N2O2S/c1-3-8-22-16-21(20-10-6-5-7-11-20)17-23(9-4-2)26(22)18-19-12-14-24(15-13-19)29(25,27)28/h5-7,10-17H,3-4,8-9,18H2,1-2H3,(H2,25,27,28)/q+1