6-[2-(2-fluoranylphenoxy)ethylamino]pyridin-1-ium-3-sulfonamide

Systemtic Name: 6-[2-(2-fluoranylphenoxy)ethylamino]pyridin-1-ium-3-sulfonamide Openeye Name: 6-[2-(2-fluorophenoxy)ethylamino]pyridin-1-ium-3-sulfonamide CAS Name: 6-[2-(2-fluorophenoxy)ethylamino]-3-pyridin-1-iumsulfonamide IUPAC Name: 6-[2-(2-fluorophenoxy)ethylamino]pyridin-1-ium-3-sulfonamide Traditional Name: 6-[2-(2-fluorophenoxy)ethylamino]pyridin-1-ium-3-sulfonamide Formula: C13H15FN3O3S+ MolecularWeight: 312.339903

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)OCCNC2=[NH+]C=C(C=C2)S(=O)(=O)N)F

Isomeric SMILES

C1=CC=C(C(=C1)OCCNC2=[NH+]C=C(C=C2)S(=O)(=O)N)F

InChI

InChI=1S/C13H14FN3O3S/c14-11-3-1-2-4-12(11)20-8-7-16-13-6-5-10(9-17-13)21(15,18)19/h1-6,9H,7-8H2,(H,16,17)(H2,15,18,19)/p+1