9,10,10-tris(oxidanylidene)-6-(3-propan-2-ylphenyl)thioxanthene-1-carboxylic acid

Systemtic Name: 9,10,10-tris(oxidanylidene)-6-(3-propan-2-ylphenyl)thioxanthene-1-carboxylic acid Openeye Name: 6-(3-isopropylphenyl)-9,10,10-trioxo-thioxanthene-1-carboxylic acid CAS Name: 9,10,10-trioxo-6-(3-propan-2-ylphenyl)-1-thioxanthenecarboxylic acid IUPAC Name: 9,10,10-trioxo-6-(3-propan-2-ylphenyl)thioxanthene-1-carboxylic acid Traditional Name: 9,10,10-triketo-6-m-cumenyl-thioxanthene-1-carboxylic acid Formula: C23H18O5S MolecularWeight: 406.45102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC(=C1)C2=CC3=C(C=C2)C(=O)C4=C(C=CC=C4S3(=O)=O)C(=O)O

Isomeric SMILES

CC(C)C1=CC=CC(=C1)C2=CC3=C(C=C2)C(=O)C4=C(C=CC=C4S3(=O)=O)C(=O)O

InChI

InChI=1S/C23H18O5S/c1-13(2)14-5-3-6-15(11-14)16-9-10-17-20(12-16)29(27,28)19-8-4-7-18(23(25)26)21(19)22(17)24/h3-13H,1-2H3,(H,25,26)