6-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-N,N-di(propan-2-yl)pyridin-1-ium-3-sulfonamide

Systemtic Name: 6-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-N,N-di(propan-2-yl)pyridin-1-ium-3-sulfonamide Openeye Name: 6-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-N,N-diisopropyl-pyridin-1-ium-3-sulfonamide CAS Name: 6-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-N,N-di(propan-2-yl)-3-pyridin-1-iumsulfonamide IUPAC Name: 6-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-N,N-di(propan-2-yl)pyridin-1-ium-3-sulfonamide Traditional Name: 6-[homoveratryl(methyl)amino]-N,N-diisopropyl-pyridin-1-ium-3-sulfonamide Formula: C22H34N3O4S+ MolecularWeight: 436.58806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C(C)C)S(=O)(=O)C1=C[NH+]=C(C=C1)N(C)CCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(C)N(C(C)C)S(=O)(=O)C1=C[NH+]=C(C=C1)N(C)CCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C22H33N3O4S/c1-16(2)25(17(3)4)30(26,27)19-9-11-22(23-15-19)24(5)13-12-18-8-10-20(28-6)21(14-18)29-7/h8-11,14-17H,12-13H2,1-7H3/p+1