9-oxidanylidene-10-sulfonyl-thioxanthene-1-carboxylic acid

Systemtic Name: 9-oxidanylidene-10-sulfonyl-thioxanthene-1-carboxylic acid Openeye Name: 9-oxo-10-sulfonyl-thioxanthene-1-carboxylic acid CAS Name: 9-oxo-10-sulfonyl-1-thioxanthenecarboxylic acid IUPAC Name: 9-oxo-10-sulfonylthioxanthene-1-carboxylic acid Traditional Name: 9-keto-10-sulfonyl-thioxanthene-1-carboxylic acid Formula: C14H8O5S2 MolecularWeight: 320.34032

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C=CC=C3S2=S(=O)=O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C=CC=C3S2=S(=O)=O)C(=O)O

InChI

InChI=1S/C14H8O5S2/c15-13-8-4-1-2-6-10(8)20(21(18)19)11-7-3-5-9(12(11)13)14(16)17/h1-7H,(H,16,17)