3-[3,4-bis(oxidanyl)phenyl]-1-oxidanylidene-thiirene-2-carboxylic acid

Systemtic Name: 3-[3,4-bis(oxidanyl)phenyl]-1-oxidanylidene-thiirene-2-carboxylic acid Openeye Name: 3-(3,4-dihydroxyphenyl)-1-oxo-thiirene-2-carboxylic acid CAS Name: 3-(3,4-dihydroxyphenyl)-1-oxo-2-thiirenecarboxylic acid IUPAC Name: 3-(3,4-dihydroxyphenyl)-1-oxothiirene-2-carboxylic acid Traditional Name: 3-(3,4-dihydroxyphenyl)-1-keto-thiirene-2-carboxylic acid Formula: C9H6O5S MolecularWeight: 226.20594

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C2=C(S2=O)C(=O)O)O)O

Isomeric SMILES

C1=CC(=C(C=C1C2=C(S2=O)C(=O)O)O)O

InChI

InChI=1S/C9H6O5S/c10-5-2-1-4(3-6(5)11)7-8(9(12)13)15(7)14/h1-3,10-11H,(H,12,13)