2-oxidanylidene-2-(7-oxidanylidenecyclohepta-1,3,5-trien-1-yl)sulfanyl-ethanoic acid

Systemtic Name: 2-oxidanylidene-2-(7-oxidanylidenecyclohepta-1,3,5-trien-1-yl)sulfanyl-ethanoic acid Openeye Name: 2-oxo-2-(7-oxocyclohepta-1,3,5-trien-1-yl)sulfanyl-acetic acid CAS Name: 2-oxo-2-[(7-oxo-1-cyclohepta-1,3,5-trienyl)thio]acetic acid IUPAC Name: 2-oxo-2-(7-oxocyclohepta-1,3,5-trien-1-yl)sulfanylacetic acid Traditional Name: 2-keto-2-[(7-ketocyclohepta-1,3,5-trien-1-yl)thio]acetic acid Formula: C9H6O4S MolecularWeight: 210.20654

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=O)C=C1)SC(=O)C(=O)O

Isomeric SMILES

C1=CC=C(C(=O)C=C1)SC(=O)C(=O)O

InChI

InChI=1S/C9H6O4S/c10-6-4-2-1-3-5-7(6)14-9(13)8(11)12/h1-5H,(H,11,12)