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

Systemtic Name: dimethyl 3-oxidanyl-3,4-dihydro-2H-thieno[3,4-b][1,4]dioxepine-6,8-dicarboxylate Openeye Name: dimethyl 3-hydroxy-3,4-dihydro-2H-thieno[3,4-b][1,4]dioxepine-6,8-dicarboxylate CAS Name: 3-hydroxy-3,4-dihydro-2H-thieno[3,4-b][1,4]dioxepin-6,8-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-hydroxy-3,4-dihydro-2H-thieno[3,4-b][1,4]dioxepine-6,8-dicarboxylate Traditional Name: 3-hydroxy-3,4-dihydro-2H-thieno[3,4-b][1,4]dioxepin-6,8-dicarboxylic acid dimethyl ester Formula: C11H12O7S MolecularWeight: 288.27378

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2C(=C(S1)C(=O)OC)OCC(CO2)O

Isomeric SMILES

COC(=O)C1=C2C(=C(S1)C(=O)OC)OCC(CO2)O

InChI

InChI=1S/C11H12O7S/c1-15-10(13)8-6-7(9(19-8)11(14)16-2)18-4-5(12)3-17-6/h5,12H,3-4H2,1-2H3