1-methyl-6-methylsulfanyl-pyridin-1-ium-3-carboxylic acid

Systemtic Name: 1-methyl-6-methylsulfanyl-pyridin-1-ium-3-carboxylic acid Openeye Name: 1-methyl-6-methylsulfanyl-pyridin-1-ium-3-carboxylic acid CAS Name: 1-methyl-6-(methylthio)-3-pyridin-1-iumcarboxylic acid IUPAC Name: 1-methyl-6-methylsulfanylpyridin-1-ium-3-carboxylic acid Traditional Name: 1-methyl-6-(methylthio)pyridin-1-ium-3-carboxylic acid Formula: C8H10NO2S+ MolecularWeight: 184.2355

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C=CC(=C1)C(=O)O)SC

Isomeric SMILES

C[N+]1=C(C=CC(=C1)C(=O)O)SC

InChI

InChI=1S/C8H9NO2S/c1-9-5-6(8(10)11)3-4-7(9)12-2/h3-5H,1-2H3/p+1