4-methoxy-N-[1-[3-(4-pyridin-2-ylphenoxy)propyl]pyrrolidin-1-ium-1-yl]benzenesulfonamide

Systemtic Name: 4-methoxy-N-[1-[3-(4-pyridin-2-ylphenoxy)propyl]pyrrolidin-1-ium-1-yl]benzenesulfonamide Openeye Name: 4-methoxy-N-[1-[3-[4-(2-pyridyl)phenoxy]propyl]pyrrolidin-1-ium-1-yl]benzenesulfonamide CAS Name: 4-methoxy-N-[1-[3-[4-(2-pyridinyl)phenoxy]propyl]-1-pyrrolidin-1-iumyl]benzenesulfonamide IUPAC Name: 4-methoxy-N-[1-[3-(4-pyridin-2-ylphenoxy)propyl]pyrrolidin-1-ium-1-yl]benzenesulfonamide Traditional Name: 4-methoxy-N-[1-[3-[4-(2-pyridyl)phenoxy]propyl]pyrrolidin-1-ium-1-yl]benzenesulfonamide Formula: C25H30N3O4S+ MolecularWeight: 468.5884

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N[N+]2(CCCC2)CCCOC3=CC=C(C=C3)C4=CC=CC=N4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N[N+]2(CCCC2)CCCOC3=CC=C(C=C3)C4=CC=CC=N4

InChI

InChI=1S/C25H30N3O4S/c1-31-22-12-14-24(15-13-22)33(29,30)27-28(17-4-5-18-28)19-6-20-32-23-10-8-21(9-11-23)25-7-2-3-16-26-25/h2-3,7-16,27H,4-6,17-20H2,1H3/q+1