[1-[4-(4-pyridin-2-yloxyphenoxy)phenyl]-1-(trifluoromethylsulfonyl)-2H-pyridin-1-ium-5-yl]methanamine

Systemtic Name: [1-[4-(4-pyridin-2-yloxyphenoxy)phenyl]-1-(trifluoromethylsulfonyl)-2H-pyridin-1-ium-5-yl]methanamine Openeye Name: [1-[4-[4-(2-pyridyloxy)phenoxy]phenyl]-1-(trifluoromethylsulfonyl)-2H-pyridin-1-ium-5-yl]methanamine CAS Name: [1-[4-[4-(2-pyridinyloxy)phenoxy]phenyl]-1-(trifluoromethylsulfonyl)-2H-pyridin-1-ium-5-yl]methanamine IUPAC Name: [1-[4-(4-pyridin-2-yloxyphenoxy)phenyl]-1-(trifluoromethylsulfonyl)-2H-pyridin-1-ium-5-yl]methanamine Traditional Name: [1-[4-[4-(2-pyridyloxy)phenoxy]phenyl]-1-triflyl-2H-pyridin-1-ium-5-yl]methylamine Formula: C24H21F3N3O4S+ MolecularWeight: 504.50145

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(=C[N+]1(C2=CC=C(C=C2)OC3=CC=C(C=C3)OC4=CC=CC=N4)S(=O)(=O)C(F)(F)F)CN

Isomeric SMILES

C1C=CC(=C[N+]1(C2=CC=C(C=C2)OC3=CC=C(C=C3)OC4=CC=CC=N4)S(=O)(=O)C(F)(F)F)CN

InChI

InChI=1S/C24H21F3N3O4S/c25-24(26,27)35(31,32)30(15-3-4-18(16-28)17-30)19-6-8-20(9-7-19)33-21-10-12-22(13-11-21)34-23-5-1-2-14-29-23/h1-14,17H,15-16,28H2/q+1