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

Systemtic Name: 4-[(2-ethyl-4,6-diphenyl-pyridin-1-ium-1-yl)methyl]benzenesulfonamide perchlorate Openeye Name: 4-[(2-ethyl-4,6-diphenyl-pyridin-1-ium-1-yl)methyl]benzenesulfonamide perchlorate CAS Name: 4-[(2-ethyl-4,6-diphenyl-1-pyridin-1-iumyl)methyl]benzenesulfonamide perchlorate IUPAC Name: 4-[(2-ethyl-4,6-diphenylpyridin-1-ium-1-yl)methyl]benzenesulfonamide perchlorate Traditional Name: 4-[(2-ethyl-4,6-diphenyl-pyridin-1-ium-1-yl)methyl]benzenesulfonamide perchlorate Formula: C26H25ClN2O6S MolecularWeight: 529.0045

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=[N+]1CC2=CC=C(C=C2)S(=O)(=O)N)C3=CC=CC=C3)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCC1=CC(=CC(=[N+]1CC2=CC=C(C=C2)S(=O)(=O)N)C3=CC=CC=C3)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C26H25N2O2S.ClHO4/c1-2-24-17-23(21-9-5-3-6-10-21)18-26(22-11-7-4-8-12-22)28(24)19-20-13-15-25(16-14-20)31(27,29)30;2-1(3,4)5/h3-18H,2,19H2,1H3,(H2,27,29,30);(H,2,3,4,5)/q+1;/p-1