3-oxidanyl-3,4-dihydro-2H-thieno[3,4-b][1,4]dioxepine-6,8-dicarboxylic acid

Systemtic Name: 3-oxidanyl-3,4-dihydro-2H-thieno[3,4-b][1,4]dioxepine-6,8-dicarboxylic acid Openeye Name: 3-hydroxy-3,4-dihydro-2H-thieno[3,4-b][1,4]dioxepine-6,8-dicarboxylic acid CAS Name: 3-hydroxy-3,4-dihydro-2H-thieno[3,4-b][1,4]dioxepin-6,8-dicarboxylic acid IUPAC Name: 3-hydroxy-3,4-dihydro-2H-thieno[3,4-b][1,4]dioxepine-6,8-dicarboxylic acid Traditional Name: 3-hydroxy-3,4-dihydro-2H-thieno[3,4-b][1,4]dioxepin-6,8-dicarboxylic acid Formula: C9H8O7S MolecularWeight: 260.22062

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Descriptors Computed from Structure

Canonical SMILES:

C1C(COC2=C(SC(=C2O1)C(=O)O)C(=O)O)O

Isomeric SMILES

C1C(COC2=C(SC(=C2O1)C(=O)O)C(=O)O)O

InChI

InChI=1S/C9H8O7S/c10-3-1-15-4-5(16-2-3)7(9(13)14)17-6(4)8(11)12/h3,10H,1-2H2,(H,11,12)(H,13,14)