(1-oxidanidylpyridin-1-ium-2-yl)sulfanylmethyl hydrogen carbonate

Systemtic Name: (1-oxidanidylpyridin-1-ium-2-yl)sulfanylmethyl hydrogen carbonate Openeye Name: (1-oxidopyridin-1-ium-2-yl)sulfanylmethyl hydrogen carbonate CAS Name: carbonic acid [(1-oxido-2-pyridin-1-iumyl)thio]methyl ester IUPAC Name: (1-oxidopyridin-1-ium-2-yl)sulfanylmethyl hydrogen carbonate Traditional Name: carbonic acid [(1-oxidopyridin-1-ium-2-yl)thio]methyl ester Formula: C7H7NO4S MolecularWeight: 201.19978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H7NO4S/c9-7(10)12-5-13-6-3-1-2-4-8(6)11/h1-4H,5H2,(H,9,10)