[4-(phenylcarbonyl)phenyl] 9,10,10-tris(oxidanylidene)thioxanthene-3-carboxylate

Systemtic Name: [4-(phenylcarbonyl)phenyl] 9,10,10-tris(oxidanylidene)thioxanthene-3-carboxylate Openeye Name: (4-benzoylphenyl) 9,10,10-trioxothioxanthene-3-carboxylate CAS Name: 9,10,10-trioxo-3-thioxanthenecarboxylic acid (4-benzoylphenyl) ester IUPAC Name: (4-benzoylphenyl) 9,10,10-trioxothioxanthene-3-carboxylate Traditional Name: 9,10,10-triketothioxanthene-3-carboxylic acid (4-benzoylphenyl) ester Formula: C27H16O6S MolecularWeight: 468.47734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)OC(=O)C3=CC4=C(C=C3)C(=O)C5=CC=CC=C5S4(=O)=O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)OC(=O)C3=CC4=C(C=C3)C(=O)C5=CC=CC=C5S4(=O)=O

InChI

InChI=1S/C27H16O6S/c28-25(17-6-2-1-3-7-17)18-10-13-20(14-11-18)33-27(30)19-12-15-22-24(16-19)34(31,32)23-9-5-4-8-21(23)26(22)29/h1-16H