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

Systemtic Name: 4-[2-[4-methyl-2,6-di(propan-2-yl)pyridin-1-ium-1-yl]ethyl]benzenesulfonamide perchlorate Openeye Name: 4-[2-(2,6-diisopropyl-4-methyl-pyridin-1-ium-1-yl)ethyl]benzenesulfonamide perchlorate CAS Name: 4-[2-[4-methyl-2,6-di(propan-2-yl)-1-pyridin-1-iumyl]ethyl]benzenesulfonamide perchlorate IUPAC Name: 4-[2-[4-methyl-2,6-di(propan-2-yl)pyridin-1-ium-1-yl]ethyl]benzenesulfonamide perchlorate Traditional Name: 4-[2-(2,6-diisopropyl-4-methyl-pyridin-1-ium-1-yl)ethyl]benzenesulfonamide perchlorate Formula: C20H29ClN2O6S MolecularWeight: 460.97206

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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(C)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(C)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C20H29N2O2S.ClHO4/c1-14(2)19-12-16(5)13-20(15(3)4)22(19)11-10-17-6-8-18(9-7-17)25(21,23)24;2-1(3,4)5/h6-9,12-15H,10-11H2,1-5H3,(H2,21,23,24);(H,2,3,4,5)/q+1;/p-1