(3-methyl-5-propan-2-yl-phenyl) 9,10,10-tris(oxidanylidene)thioxanthene-3-carboxylate

Systemtic Name: (3-methyl-5-propan-2-yl-phenyl) 9,10,10-tris(oxidanylidene)thioxanthene-3-carboxylate Openeye Name: (3-isopropyl-5-methyl-phenyl) 9,10,10-trioxothioxanthene-3-carboxylate CAS Name: 9,10,10-trioxo-3-thioxanthenecarboxylic acid (3-methyl-5-propan-2-ylphenyl) ester IUPAC Name: (3-methyl-5-propan-2-ylphenyl) 9,10,10-trioxothioxanthene-3-carboxylate Traditional Name: 9,10,10-triketothioxanthene-3-carboxylic acid (3-isopropyl-5-methyl-phenyl) ester Formula: C24H20O5S MolecularWeight: 420.4776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O)C(C)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O)C(C)C

InChI

InChI=1S/C24H20O5S/c1-14(2)17-10-15(3)11-18(12-17)29-24(26)16-8-9-20-22(13-16)30(27,28)21-7-5-4-6-19(21)23(20)25/h4-14H,1-3H3