N-ethyl-6-[(4-methoxyphenyl)methyl-methyl-amino]-N-phenyl-pyridin-1-ium-3-sulfonamide

Systemtic Name: N-ethyl-6-[(4-methoxyphenyl)methyl-methyl-amino]-N-phenyl-pyridin-1-ium-3-sulfonamide Openeye Name: N-ethyl-6-[(4-methoxyphenyl)methyl-methyl-amino]-N-phenyl-pyridin-1-ium-3-sulfonamide CAS Name: N-ethyl-6-[(4-methoxyphenyl)methyl-methylamino]-N-phenyl-3-pyridin-1-iumsulfonamide IUPAC Name: N-ethyl-6-[(4-methoxyphenyl)methyl-methylamino]-N-phenylpyridin-1-ium-3-sulfonamide Traditional Name: N-ethyl-6-[methyl(p-anisyl)amino]-N-phenyl-pyridin-1-ium-3-sulfonamide Formula: C22H26N3O3S+ MolecularWeight: 412.52514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=C[NH+]=C(C=C2)N(C)CC3=CC=C(C=C3)OC

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=C[NH+]=C(C=C2)N(C)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H25N3O3S/c1-4-25(19-8-6-5-7-9-19)29(26,27)21-14-15-22(23-16-21)24(2)17-18-10-12-20(28-3)13-11-18/h5-16H,4,17H2,1-3H3/p+1