methyl 6-ethyl-4-oxidanyl-1,1-bis(oxidanylidene)-3,4-dihydro-2H-thiochromene-7-carboxylate

Systemtic Name: methyl 6-ethyl-4-oxidanyl-1,1-bis(oxidanylidene)-3,4-dihydro-2H-thiochromene-7-carboxylate Openeye Name: methyl 6-ethyl-4-hydroxy-1,1-dioxo-3,4-dihydro-2H-thiochromene-7-carboxylate CAS Name: 6-ethyl-4-hydroxy-1,1-dioxo-3,4-dihydro-2H-1-benzothiopyran-7-carboxylic acid methyl ester IUPAC Name: methyl 6-ethyl-4-hydroxy-1,1-dioxo-3,4-dihydro-2H-thiochromene-7-carboxylate Traditional Name: 6-ethyl-4-hydroxy-1,1-diketo-3,4-dihydro-2H-thiochromene-7-carboxylic acid methyl ester Formula: C13H16O5S MolecularWeight: 284.32814

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1C(=O)OC)S(=O)(=O)CCC2O

Isomeric SMILES

CCC1=CC2=C(C=C1C(=O)OC)S(=O)(=O)CCC2O

InChI

InChI=1S/C13H16O5S/c1-3-8-6-10-11(14)4-5-19(16,17)12(10)7-9(8)13(15)18-2/h6-7,11,14H,3-5H2,1-2H3