ethyl 4,7,7-tris(oxidanylidene)-6-propyl-5H-thieno[2,3-b]thiopyran-6-carboxylate

Systemtic Name: ethyl 4,7,7-tris(oxidanylidene)-6-propyl-5H-thieno[2,3-b]thiopyran-6-carboxylate Openeye Name: ethyl 4,7,7-trioxo-6-propyl-5H-thieno[2,3-b]thiopyran-6-carboxylate CAS Name: 4,7,7-trioxo-6-propyl-5H-thieno[2,3-b]thiopyran-6-carboxylic acid ethyl ester IUPAC Name: ethyl 4,7,7-trioxo-6-propyl-5H-thieno[2,3-b]thiopyran-6-carboxylate Traditional Name: 4,7,7-triketo-6-propyl-5H-thieno[2,3-b]thiopyran-6-carboxylic acid ethyl ester Formula: C13H16O5S2 MolecularWeight: 316.39314

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CC(=O)C2=C(S1(=O)=O)SC=C2)C(=O)OCC

Isomeric SMILES

CCCC1(CC(=O)C2=C(S1(=O)=O)SC=C2)C(=O)OCC

InChI

InChI=1S/C13H16O5S2/c1-3-6-13(12(15)18-4-2)8-10(14)9-5-7-19-11(9)20(13,16)17/h5,7H,3-4,6,8H2,1-2H3