9-oxidanylidenethioxanthene-2,3,6,7-tetracarboxylic acid

Systemtic Name: 9-oxidanylidenethioxanthene-2,3,6,7-tetracarboxylic acid Openeye Name: 9-oxothioxanthene-2,3,6,7-tetracarboxylic acid CAS Name: 9-oxothioxanthene-2,3,6,7-tetracarboxylic acid IUPAC Name: 9-oxothioxanthene-2,3,6,7-tetracarboxylic acid Traditional Name: 9-ketothioxanthene-2,3,6,7-tetracarboxylic acid Formula: C17H8O9S MolecularWeight: 388.30502

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Descriptors Computed from Structure

Canonical SMILES:

C1=C2C(=CC(=C1C(=O)O)C(=O)O)SC3=CC(=C(C=C3C2=O)C(=O)O)C(=O)O

Isomeric SMILES

C1=C2C(=CC(=C1C(=O)O)C(=O)O)SC3=CC(=C(C=C3C2=O)C(=O)O)C(=O)O

InChI

InChI=1S/C17H8O9S/c18-13-9-1-5(14(19)20)7(16(23)24)3-11(9)27-12-4-8(17(25)26)6(15(21)22)2-10(12)13/h1-4H,(H,19,20)(H,21,22)(H,23,24)(H,25,26)