dimethyl 4-oxidanylidene-2,6-diphenyl-thiopyran-3,5-dicarboxylate

Systemtic Name: dimethyl 4-oxidanylidene-2,6-diphenyl-thiopyran-3,5-dicarboxylate Openeye Name: dimethyl 4-oxo-2,6-diphenyl-thiopyran-3,5-dicarboxylate CAS Name: 4-oxo-2,6-diphenylthiopyran-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-oxo-2,6-diphenylthiopyran-3,5-dicarboxylate Traditional Name: 4-keto-2,6-diphenyl-thiopyran-3,5-dicarboxylic acid dimethyl ester Formula: C21H16O5S MolecularWeight: 380.41374

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C(C1=O)C(=O)OC)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(SC(=C(C1=O)C(=O)OC)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H16O5S/c1-25-20(23)15-17(22)16(21(24)26-2)19(14-11-7-4-8-12-14)27-18(15)13-9-5-3-6-10-13/h3-12H,1-2H3