N-ethyl-6-[methyl(2-phenoxyethyl)amino]-N-phenyl-pyridin-1-ium-3-sulfonamide

Systemtic Name: N-ethyl-6-[methyl(2-phenoxyethyl)amino]-N-phenyl-pyridin-1-ium-3-sulfonamide Openeye Name: N-ethyl-6-[methyl(2-phenoxyethyl)amino]-N-phenyl-pyridin-1-ium-3-sulfonamide CAS Name: N-ethyl-6-[methyl(2-phenoxyethyl)amino]-N-phenyl-3-pyridin-1-iumsulfonamide IUPAC Name: N-ethyl-6-[methyl(2-phenoxyethyl)amino]-N-phenylpyridin-1-ium-3-sulfonamide Traditional Name: N-ethyl-6-[methyl(2-phenoxyethyl)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)CCOC3=CC=CC=C3

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=C[NH+]=C(C=C2)N(C)CCOC3=CC=CC=C3

InChI

InChI=1S/C22H25N3O3S/c1-3-25(19-10-6-4-7-11-19)29(26,27)21-14-15-22(23-18-21)24(2)16-17-28-20-12-8-5-9-13-20/h4-15,18H,3,16-17H2,1-2H3/p+1