[4-(1,3-dithiolan-2-yl)phenyl] 9,10,10-tris(oxidanylidene)thioxanthene-3-carboxylate

Systemtic Name: [4-(1,3-dithiolan-2-yl)phenyl] 9,10,10-tris(oxidanylidene)thioxanthene-3-carboxylate Openeye Name: [4-(1,3-dithiolan-2-yl)phenyl] 9,10,10-trioxothioxanthene-3-carboxylate CAS Name: 9,10,10-trioxo-3-thioxanthenecarboxylic acid [4-(1,3-dithiolan-2-yl)phenyl] ester IUPAC Name: [4-(1,3-dithiolan-2-yl)phenyl] 9,10,10-trioxothioxanthene-3-carboxylate Traditional Name: 9,10,10-triketothioxanthene-3-carboxylic acid [4-(1,3-dithiolan-2-yl)phenyl] ester Formula: C23H16O5S3 MolecularWeight: 468.56514

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(S1)C2=CC=C(C=C2)OC(=O)C3=CC4=C(C=C3)C(=O)C5=CC=CC=C5S4(=O)=O

Isomeric SMILES

C1CSC(S1)C2=CC=C(C=C2)OC(=O)C3=CC4=C(C=C3)C(=O)C5=CC=CC=C5S4(=O)=O

InChI

InChI=1S/C23H16O5S3/c24-21-17-3-1-2-4-19(17)31(26,27)20-13-15(7-10-18(20)21)22(25)28-16-8-5-14(6-9-16)23-29-11-12-30-23/h1-10,13,23H,11-12H2