1-[(4-fluorophenyl)methyl]-4-(methylsulfonylmethyl)pyridin-1-ium chloride

Systemtic Name: 1-[(4-fluorophenyl)methyl]-4-(methylsulfonylmethyl)pyridin-1-ium chloride Openeye Name: 1-[(4-fluorophenyl)methyl]-4-(methylsulfonylmethyl)pyridin-1-ium chloride CAS Name: 1-[(4-fluorophenyl)methyl]-4-(methylsulfonylmethyl)pyridin-1-ium chloride IUPAC Name: 1-[(4-fluorophenyl)methyl]-4-(methylsulfonylmethyl)pyridin-1-ium chloride Traditional Name: 1-(4-fluorobenzyl)-4-(mesylmethyl)pyridin-1-ium chloride Formula: C14H15ClFNO2S MolecularWeight: 315.790803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CC1=CC=[N+](C=C1)CC2=CC=C(C=C2)F.[Cl-]

Isomeric SMILES

CS(=O)(=O)CC1=CC=[N+](C=C1)CC2=CC=C(C=C2)F.[Cl-]

InChI

InChI=1S/C14H15FNO2S.ClH/c1-19(17,18)11-13-6-8-16(9-7-13)10-12-2-4-14(15)5-3-12;/h2-9H,10-11H2,1H3;1H/q+1;/p-1