3,3-diethyl-2,4-dihydrothieno[3,4-b][1,4]dioxepine-6,8-dicarboxylic acid

Systemtic Name: 3,3-diethyl-2,4-dihydrothieno[3,4-b][1,4]dioxepine-6,8-dicarboxylic acid Openeye Name: 3,3-diethyl-2,4-dihydrothieno[3,4-b][1,4]dioxepine-6,8-dicarboxylic acid CAS Name: 3,3-diethyl-2,4-dihydrothieno[3,4-b][1,4]dioxepin-6,8-dicarboxylic acid IUPAC Name: 3,3-diethyl-2,4-dihydrothieno[3,4-b][1,4]dioxepine-6,8-dicarboxylic acid Traditional Name: 3,3-diethyl-2,4-dihydrothieno[3,4-b][1,4]dioxepin-6,8-dicarboxylic acid Formula: C13H16O6S MolecularWeight: 300.32754

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(COC2=C(SC(=C2OC1)C(=O)O)C(=O)O)CC

Isomeric SMILES

CCC1(COC2=C(SC(=C2OC1)C(=O)O)C(=O)O)CC

InChI

InChI=1S/C13H16O6S/c1-3-13(4-2)5-18-7-8(19-6-13)10(12(16)17)20-9(7)11(14)15/h3-6H2,1-2H3,(H,14,15)(H,16,17)