2-(4-phenylsulfanylpyridin-1-ium-1-yl)ethanol

Systemtic Name: 2-(4-phenylsulfanylpyridin-1-ium-1-yl)ethanol Openeye Name: 2-(4-phenylsulfanylpyridin-1-ium-1-yl)ethanol CAS Name: 2-[4-(phenylthio)-1-pyridin-1-iumyl]ethanol IUPAC Name: 2-(4-phenylsulfanylpyridin-1-ium-1-yl)ethanol Traditional Name: 2-[4-(phenylthio)pyridin-1-ium-1-yl]ethanol Formula: C13H14NOS+ MolecularWeight: 232.32136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC=[N+](C=C2)CCO

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC=[N+](C=C2)CCO

InChI

InChI=1S/C13H14NOS/c15-11-10-14-8-6-13(7-9-14)16-12-4-2-1-3-5-12/h1-9,15H,10-11H2/q+1