6-[(3-fluorophenyl)methyl-methyl-amino]pyridin-1-ium-3-sulfonamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC=C1)F)C2=[NH+]C=C(C=C2)S(=O)(=O)N

Isomeric SMILES

CN(CC1=CC(=CC=C1)F)C2=[NH+]C=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C13H14FN3O2S/c1-17(9-10-3-2-4-11(14)7-10)13-6-5-12(8-16-13)20(15,18)19/h2-8H,9H2,1H3,(H2,15,18,19)/p+1