7-acetyloxy-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxylic acid

Systemtic Name: 7-acetyloxy-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxylic acid Openeye Name: 7-acetoxy-9,10,10-trioxo-thioxanthene-3-carboxylic acid CAS Name: 7-acetyloxy-9,10,10-trioxo-3-thioxanthenecarboxylic acid IUPAC Name: 7-acetyloxy-9,10,10-trioxothioxanthene-3-carboxylic acid Traditional Name: 7-acetoxy-9,10,10-triketo-thioxanthene-3-carboxylic acid Formula: C16H10O7S MolecularWeight: 346.3114

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC2=C(C=C1)S(=O)(=O)C3=C(C2=O)C=CC(=C3)C(=O)O

Isomeric SMILES

CC(=O)OC1=CC2=C(C=C1)S(=O)(=O)C3=C(C2=O)C=CC(=C3)C(=O)O

InChI

InChI=1S/C16H10O7S/c1-8(17)23-10-3-5-13-12(7-10)15(18)11-4-2-9(16(19)20)6-14(11)24(13,21)22/h2-7H,1H3,(H,19,20)