9-oxidanylidene-7-sulfanyl-xanthene-2-carboxylic acid

Systemtic Name: 9-oxidanylidene-7-sulfanyl-xanthene-2-carboxylic acid Openeye Name: 9-oxo-7-sulfanyl-xanthene-2-carboxylic acid CAS Name: 7-mercapto-9-oxo-2-xanthenecarboxylic acid IUPAC Name: 9-oxo-7-sulfanylxanthene-2-carboxylic acid Traditional Name: 9-keto-7-mercapto-xanthene-2-carboxylic acid Formula: C14H8O4S MolecularWeight: 272.27592

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)O)C(=O)C3=C(O2)C=CC(=C3)S

Isomeric SMILES

C1=CC2=C(C=C1C(=O)O)C(=O)C3=C(O2)C=CC(=C3)S

InChI

InChI=1S/C14H8O4S/c15-13-9-5-7(14(16)17)1-3-11(9)18-12-4-2-8(19)6-10(12)13/h1-6,19H,(H,16,17)