(2-bromophenyl) 9,10,10-tris(oxidanylidene)thioxanthene-3-carboxylate

Systemtic Name: (2-bromophenyl) 9,10,10-tris(oxidanylidene)thioxanthene-3-carboxylate Openeye Name: (2-bromophenyl) 9,10,10-trioxothioxanthene-3-carboxylate CAS Name: 9,10,10-trioxo-3-thioxanthenecarboxylic acid (2-bromophenyl) ester IUPAC Name: (2-bromophenyl) 9,10,10-trioxothioxanthene-3-carboxylate Traditional Name: 9,10,10-triketothioxanthene-3-carboxylic acid (2-bromophenyl) ester Formula: C20H11BrO5S MolecularWeight: 443.26734

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(S2(=O)=O)C=C(C=C3)C(=O)OC4=CC=CC=C4Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(S2(=O)=O)C=C(C=C3)C(=O)OC4=CC=CC=C4Br

InChI

InChI=1S/C20H11BrO5S/c21-15-6-2-3-7-16(15)26-20(23)12-9-10-14-18(11-12)27(24,25)17-8-4-1-5-13(17)19(14)22/h1-11H