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

Systemtic Name: 4-[2-(2,6-diethyl-4-phenyl-pyridin-1-ium-1-yl)ethyl]benzenesulfonamide perchlorate Openeye Name: 4-[2-(2,6-diethyl-4-phenyl-pyridin-1-ium-1-yl)ethyl]benzenesulfonamide perchlorate CAS Name: 4-[2-(2,6-diethyl-4-phenyl-1-pyridin-1-iumyl)ethyl]benzenesulfonamide perchlorate IUPAC Name: 4-[2-(2,6-diethyl-4-phenylpyridin-1-ium-1-yl)ethyl]benzenesulfonamide perchlorate Traditional Name: 4-[2-(2,6-diethyl-4-phenyl-pyridin-1-ium-1-yl)ethyl]benzenesulfonamide perchlorate Formula: C23H27ClN2O6S MolecularWeight: 494.98828

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=[N+]1CCC2=CC=C(C=C2)S(=O)(=O)N)CC)C3=CC=CC=C3.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCC1=CC(=CC(=[N+]1CCC2=CC=C(C=C2)S(=O)(=O)N)CC)C3=CC=CC=C3.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C23H27N2O2S.ClHO4/c1-3-21-16-20(19-8-6-5-7-9-19)17-22(4-2)25(21)15-14-18-10-12-23(13-11-18)28(24,26)27;2-1(3,4)5/h5-13,16-17H,3-4,14-15H2,1-2H3,(H2,24,26,27);(H,2,3,4,5)/q+1;/p-1