[1-(2-sulfanylethyl)pyridin-1-ium-4-yl]methanesulfonic acid hydroxide

Systemtic Name: [1-(2-sulfanylethyl)pyridin-1-ium-4-yl]methanesulfonic acid hydroxide Openeye Name: [1-(2-sulfanylethyl)pyridin-1-ium-4-yl]methanesulfonic acid hydroxide CAS Name: [1-(2-mercaptoethyl)-4-pyridin-1-iumyl]methanesulfonic acid hydroxide IUPAC Name: [1-(2-sulfanylethyl)pyridin-1-ium-4-yl]methanesulfonic acid hydroxide Traditional Name: [1-(2-mercaptoethyl)pyridin-1-ium-4-yl]methanesulfonic acid hydroxide Formula: C8H13NO4S2 MolecularWeight: 251.32312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C[N+](=CC=C1CS(=O)(=O)O)CCS.[OH-]

Isomeric SMILES

C1=C[N+](=CC=C1CS(=O)(=O)O)CCS.[OH-]

InChI

InChI=1S/C8H11NO3S2.H2O/c10-14(11,12)7-8-1-3-9(4-2-8)5-6-13;/h1-4H,5-7H2,(H-,10,11,12,13);1H2