N-[4-[2-[3-[2,4-bis(fluoranyl)phenoxy]pyridin-1-ium-1-yl]ethanoyl]phenyl]methanesulfonamide

Systemtic Name: N-[4-[2-[3-[2,4-bis(fluoranyl)phenoxy]pyridin-1-ium-1-yl]ethanoyl]phenyl]methanesulfonamide Openeye Name: N-[4-[2-[3-(2,4-difluorophenoxy)pyridin-1-ium-1-yl]acetyl]phenyl]methanesulfonamide CAS Name: N-[4-[2-[3-(2,4-difluorophenoxy)-1-pyridin-1-iumyl]-1-oxoethyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[2-[3-(2,4-difluorophenoxy)pyridin-1-ium-1-yl]acetyl]phenyl]methanesulfonamide Traditional Name: N-[4-[2-[3-(2,4-difluorophenoxy)pyridin-1-ium-1-yl]acetyl]phenyl]methanesulfonamide Formula: C20H17F2N2O4S+ MolecularWeight: 419.421786

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)C[N+]2=CC=CC(=C2)OC3=C(C=C(C=C3)F)F

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)C[N+]2=CC=CC(=C2)OC3=C(C=C(C=C3)F)F

InChI

InChI=1S/C20H16F2N2O4S/c1-29(26,27)23-16-7-4-14(5-8-16)19(25)13-24-10-2-3-17(12-24)28-20-9-6-15(21)11-18(20)22/h2-12H,13H2,1H3/p+1