diphenyl 9-oxidanylidenethioxanthene-1,2-dicarboxylate

Systemtic Name: diphenyl 9-oxidanylidenethioxanthene-1,2-dicarboxylate Openeye Name: diphenyl 9-oxothioxanthene-1,2-dicarboxylate CAS Name: 9-oxothioxanthene-1,2-dicarboxylic acid diphenyl ester IUPAC Name: diphenyl 9-oxothioxanthene-1,2-dicarboxylate Traditional Name: 9-ketothioxanthene-1,2-dicarboxylic acid diphenyl ester Formula: C27H16O5S MolecularWeight: 452.47794

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(=O)C2=C(C3=C(C=C2)SC4=CC=CC=C4C3=O)C(=O)OC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)OC(=O)C2=C(C3=C(C=C2)SC4=CC=CC=C4C3=O)C(=O)OC5=CC=CC=C5

InChI

InChI=1S/C27H16O5S/c28-25-19-13-7-8-14-21(19)33-22-16-15-20(26(29)31-17-9-3-1-4-10-17)23(24(22)25)27(30)32-18-11-5-2-6-12-18/h1-16H