sodium; 9,10,10-tris(oxidanylidene)thioxanthene-4-carboxylic acid

Systemtic Name: sodium; 9,10,10-tris(oxidanylidene)thioxanthene-4-carboxylic acid Openeye Name: sodium; 9,10,10-trioxothioxanthene-4-carboxylic acid CAS Name: sodium; 9,10,10-trioxo-4-thioxanthenecarboxylic acid IUPAC Name: sodium; 9,10,10-trioxothioxanthene-4-carboxylic acid Traditional Name: sodium; 9,10,10-triketothioxanthene-4-carboxylic acid Formula: C14H8NaO5S MolecularWeight: 311.26509

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(S2(=O)=O)C(=CC=C3)C(=O)O.[Na]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(S2(=O)=O)C(=CC=C3)C(=O)O.[Na]

InChI

InChI=1S/C14H8O5S.Na/c15-12-8-4-1-2-7-11(8)20(18,19)13-9(12)5-3-6-10(13)14(16)17;/h1-7H,(H,16,17);