9,10,10-tris(oxidanylidene)-6-(2H-1,2,3,4-tetrazol-5-yl)thioxanthene-2-carboxylic acid

Systemtic Name: 9,10,10-tris(oxidanylidene)-6-(2H-1,2,3,4-tetrazol-5-yl)thioxanthene-2-carboxylic acid Openeye Name: 9,10,10-trioxo-6-(2H-tetrazol-5-yl)thioxanthene-2-carboxylic acid CAS Name: 9,10,10-trioxo-6-(2H-tetrazol-5-yl)-2-thioxanthenecarboxylic acid IUPAC Name: 9,10,10-trioxo-6-(2H-tetrazol-5-yl)thioxanthene-2-carboxylic acid Traditional Name: 9,10,10-triketo-6-(2H-tetrazol-5-yl)thioxanthene-2-carboxylic acid Formula: C15H8N4O5S MolecularWeight: 356.31282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C3=NNN=N3)S(=O)(=O)C4=C(C2=O)C=C(C=C4)C(=O)O

Isomeric SMILES

C1=CC2=C(C=C1C3=NNN=N3)S(=O)(=O)C4=C(C2=O)C=C(C=C4)C(=O)O

InChI

InChI=1S/C15H8N4O5S/c20-13-9-3-1-7(14-16-18-19-17-14)6-12(9)25(23,24)11-4-2-8(15(21)22)5-10(11)13/h1-6H,(H,21,22)(H,16,17,18,19)