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

Systemtic Name: [1-(2-sulfanylethyl)pyridin-1-ium-4-yl]methanesulfonic acid Openeye Name: [1-(2-sulfanylethyl)pyridin-1-ium-4-yl]methanesulfonic acid CAS Name: [1-(2-mercaptoethyl)-4-pyridin-1-iumyl]methanesulfonic acid IUPAC Name: [1-(2-sulfanylethyl)pyridin-1-ium-4-yl]methanesulfonic acid Traditional Name: [1-(2-mercaptoethyl)pyridin-1-ium-4-yl]methanesulfonic acid Formula: C8H12NO3S2+ MolecularWeight: 234.31578

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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