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

Systemtic Name: 6-[2-(3-fluorophenyl)ethylamino]pyridin-1-ium-3-sulfonamide Openeye Name: 6-[2-(3-fluorophenyl)ethylamino]pyridin-1-ium-3-sulfonamide CAS Name: 6-[2-(3-fluorophenyl)ethylamino]-3-pyridin-1-iumsulfonamide IUPAC Name: 6-[2-(3-fluorophenyl)ethylamino]pyridin-1-ium-3-sulfonamide Traditional Name: 6-[2-(3-fluorophenyl)ethylamino]pyridin-1-ium-3-sulfonamide Formula: C13H15FN3O2S+ MolecularWeight: 296.340503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)CCNC2=[NH+]C=C(C=C2)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC(=C1)F)CCNC2=[NH+]C=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C13H14FN3O2S/c14-11-3-1-2-10(8-11)6-7-16-13-5-4-12(9-17-13)20(15,18)19/h1-5,8-9H,6-7H2,(H,16,17)(H2,15,18,19)/p+1