2-(fluoranylmethyl)pyridin-1-ium; phenylmethanesulfonate

Systemtic Name: 2-(fluoranylmethyl)pyridin-1-ium; phenylmethanesulfonate Openeye Name: 2-(fluoromethyl)pyridin-1-ium; phenylmethanesulfonate CAS Name: 2-(fluoromethyl)pyridin-1-ium; phenylmethanesulfonate IUPAC Name: 2-(fluoromethyl)pyridin-1-ium; phenylmethanesulfonate Traditional Name: 2-(fluoromethyl)pyridin-1-ium; phenylmethanesulfonate Formula: C13H14FNO3S MolecularWeight: 283.318563

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)[O-].C1=CC=[NH+]C(=C1)CF

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)[O-].C1=CC=[NH+]C(=C1)CF

InChI

InChI=1S/C7H8O3S.C6H6FN/c8-11(9,10)6-7-4-2-1-3-5-7;7-5-6-3-1-2-4-8-6/h1-5H,6H2,(H,8,9,10);1-4H,5H2