ethyl 1,1,4,4-tetrakis(oxidanylidene)-6-pentyl-2,3-dihydro-1,4-dithiine-5-carboxylate

Systemtic Name: ethyl 1,1,4,4-tetrakis(oxidanylidene)-6-pentyl-2,3-dihydro-1,4-dithiine-5-carboxylate Openeye Name: ethyl 1,1,4,4-tetraoxo-6-pentyl-2,3-dihydro-1,4-dithiine-5-carboxylate CAS Name: 1,1,4,4-tetraoxo-6-pentyl-2,3-dihydro-1,4-dithiin-5-carboxylic acid ethyl ester IUPAC Name: ethyl 1,1,4,4-tetraoxo-6-pentyl-2,3-dihydro-1,4-dithiine-5-carboxylate Traditional Name: 6-amyl-1,1,4,4-tetraketo-2,3-dihydro-1,4-dithiin-5-carboxylic acid ethyl ester Formula: C12H20O6S2 MolecularWeight: 324.4136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(S(=O)(=O)CCS1(=O)=O)C(=O)OCC

Isomeric SMILES

CCCCCC1=C(S(=O)(=O)CCS1(=O)=O)C(=O)OCC

InChI

InChI=1S/C12H20O6S2/c1-3-5-6-7-10-11(12(13)18-4-2)20(16,17)9-8-19(10,14)15/h3-9H2,1-2H3