2-(1-oxidanidylpyridin-1-ium-2-yl)-2-sulfanyl-ethanoic acid

Systemtic Name: 2-(1-oxidanidylpyridin-1-ium-2-yl)-2-sulfanyl-ethanoic acid Openeye Name: 2-(1-oxidopyridin-1-ium-2-yl)-2-sulfanyl-acetic acid CAS Name: 2-mercapto-2-(1-oxido-2-pyridin-1-iumyl)acetic acid IUPAC Name: 2-(1-oxidopyridin-1-ium-2-yl)-2-sulfanylacetic acid Traditional Name: 2-mercapto-2-(1-oxidopyridin-1-ium-2-yl)acetic acid Formula: C7H7NO3S MolecularWeight: 185.20038

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C(=C1)C(C(=O)O)S)[O-]

Isomeric SMILES

C1=CC=[N+](C(=C1)C(C(=O)O)S)[O-]

InChI

InChI=1S/C7H7NO3S/c9-7(10)6(12)5-3-1-2-4-8(5)11/h1-4,6,12H,(H,9,10)