3-(2,6-dimethyl-4-phenyl-pyridin-1-ium-1-yl)-N-[2-(4-sulfamoylphenyl)ethyl]propanamide

Systemtic Name: 3-(2,6-dimethyl-4-phenyl-pyridin-1-ium-1-yl)-N-[2-(4-sulfamoylphenyl)ethyl]propanamide Openeye Name: 3-(2,6-dimethyl-4-phenyl-pyridin-1-ium-1-yl)-N-[2-(4-sulfamoylphenyl)ethyl]propanamide CAS Name: 3-(2,6-dimethyl-4-phenyl-1-pyridin-1-iumyl)-N-[2-(4-sulfamoylphenyl)ethyl]propanamide IUPAC Name: 3-(2,6-dimethyl-4-phenylpyridin-1-ium-1-yl)-N-[2-(4-sulfamoylphenyl)ethyl]propanamide Traditional Name: 3-(2,6-dimethyl-4-phenyl-pyridin-1-ium-1-yl)-N-[2-(4-sulfamoylphenyl)ethyl]propionamide Formula: C24H28N3O3S+ MolecularWeight: 438.56242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=[N+]1CCC(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N)C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC(=[N+]1CCC(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N)C)C3=CC=CC=C3

InChI

InChI=1S/C24H27N3O3S/c1-18-16-22(21-6-4-3-5-7-21)17-19(2)27(18)15-13-24(28)26-14-12-20-8-10-23(11-9-20)31(25,29)30/h3-11,16-17H,12-15H2,1-2H3,(H2-,25,26,28,29,30)/p+1