1-(2-sulfanylethyl)pyridin-1-ium-3-carboxylic acid

Systemtic Name: 1-(2-sulfanylethyl)pyridin-1-ium-3-carboxylic acid Openeye Name: 1-(2-sulfanylethyl)pyridin-1-ium-3-carboxylic acid CAS Name: 1-(2-mercaptoethyl)-3-pyridin-1-iumcarboxylic acid IUPAC Name: 1-(2-sulfanylethyl)pyridin-1-ium-3-carboxylic acid Traditional Name: 1-(2-mercaptoethyl)pyridin-1-ium-3-carboxylic acid Formula: C8H10NO2S+ MolecularWeight: 184.2355

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H9NO2S/c10-8(11)7-2-1-3-9(6-7)4-5-12/h1-3,6H,4-5H2,(H-,10,11,12)/p+1