4-(2,6-diethyl-4-phenyl-pyridin-1-ium-1-yl)benzenesulfonamide chlorate

Systemtic Name: 4-(2,6-diethyl-4-phenyl-pyridin-1-ium-1-yl)benzenesulfonamide chlorate Openeye Name: 4-(2,6-diethyl-4-phenyl-pyridin-1-ium-1-yl)benzenesulfonamide chlorate CAS Name: 4-(2,6-diethyl-4-phenyl-1-pyridin-1-iumyl)benzenesulfonamide chlorate IUPAC Name: 4-(2,6-diethyl-4-phenylpyridin-1-ium-1-yl)benzenesulfonamide chlorate Traditional Name: 4-(2,6-diethyl-4-phenyl-pyridin-1-ium-1-yl)benzenesulfonamide chlorate Formula: C21H23ClN2O5S MolecularWeight: 450.93572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N2O2S.ClHO3/c1-3-18-14-17(16-8-6-5-7-9-16)15-19(4-2)23(18)20-10-12-21(13-11-20)26(22,24)25;2-1(3)4/h5-15H,3-4H2,1-2H3,(H2,22,24,25);(H,2,3,4)/q+1;/p-1