2-(pyridin-1-ium-4-ylmethylsulfanyl)ethanol

Systemtic Name: 2-(pyridin-1-ium-4-ylmethylsulfanyl)ethanol Openeye Name: 2-(pyridin-1-ium-4-ylmethylsulfanyl)ethanol CAS Name: 2-(4-pyridin-1-iumylmethylthio)ethanol IUPAC Name: 2-(pyridin-1-ium-4-ylmethylsulfanyl)ethanol Traditional Name: 2-(pyridin-1-ium-4-ylmethylthio)ethanol Formula: C8H12NOS+ MolecularWeight: 170.25198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C[NH+]=CC=C1CSCCO

Isomeric SMILES

C1=C[NH+]=CC=C1CSCCO

InChI

InChI=1S/C8H11NOS/c10-5-6-11-7-8-1-3-9-4-2-8/h1-4,10H,5-7H2/p+1