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

Systemtic Name: 4-[2-(2,4-dimethyl-6-propan-2-yl-pyridin-1-ium-1-yl)ethyl]benzenesulfonamide perchlorate Openeye Name: 4-[2-(2-isopropyl-4,6-dimethyl-pyridin-1-ium-1-yl)ethyl]benzenesulfonamide perchlorate CAS Name: 4-[2-(2,4-dimethyl-6-propan-2-yl-1-pyridin-1-iumyl)ethyl]benzenesulfonamide perchlorate IUPAC Name: 4-[2-(2,4-dimethyl-6-propan-2-ylpyridin-1-ium-1-yl)ethyl]benzenesulfonamide perchlorate Traditional Name: 4-[2-(2-isopropyl-4,6-dimethyl-pyridin-1-ium-1-yl)ethyl]benzenesulfonamide perchlorate Formula: C18H25ClN2O6S MolecularWeight: 432.9189

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+](C(=C1)C(C)C)CCC2=CC=C(C=C2)S(=O)(=O)N)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC(=[N+](C(=C1)C(C)C)CCC2=CC=C(C=C2)S(=O)(=O)N)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C18H25N2O2S.ClHO4/c1-13(2)18-12-14(3)11-15(4)20(18)10-9-16-5-7-17(8-6-16)23(19,21)22;2-1(3,4)5/h5-8,11-13H,9-10H2,1-4H3,(H2,19,21,22);(H,2,3,4,5)/q+1;/p-1