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1-methyl-2-methylsulfanyl-pyridin-1-ium-3-carboxylic acid

1-methyl-2-methylsulfanyl-pyridin-1-ium-3-carboxylic acid

Systemtic Name:1-methyl-2-methylsulfanyl-pyridin-1-ium-3-carboxylic acid
Openeye Name:1-methyl-2-methylsulfanyl-pyridin-1-ium-3-carboxylic acid
CAS Name:1-methyl-2-(methylthio)-3-pyridin-1-iumcarboxylic acid
IUPAC Name:1-methyl-2-methylsulfanylpyridin-1-ium-3-carboxylic acid
Traditional Name:1-methyl-2-(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=CC=CC(=C1SC)C(=O)O


Isomeric SMILES

C[N+]1=CC=CC(=C1SC)C(=O)O


InChI

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


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