1,3-dimethylthiepino[4,5-c]furan-5,7-dicarboxylic acid

Systemtic Name: 1,3-dimethylthiepino[4,5-c]furan-5,7-dicarboxylic acid Openeye Name: 1,3-dimethylthiepino[4,5-c]furan-5,7-dicarboxylic acid CAS Name: 1,3-dimethylthiepino[4,5-c]furan-5,7-dicarboxylic acid IUPAC Name: 1,3-dimethylthiepino[4,5-c]furan-5,7-dicarboxylic acid Traditional Name: 1,3-dimethylthiepino[4,5-c]furan-5,7-dicarboxylic acid Formula: C12H10O5S MolecularWeight: 266.2698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(SC(=CC2=C(O1)C)C(=O)O)C(=O)O

Isomeric SMILES

CC1=C2C=C(SC(=CC2=C(O1)C)C(=O)O)C(=O)O

InChI

InChI=1S/C12H10O5S/c1-5-7-3-9(11(13)14)18-10(12(15)16)4-8(7)6(2)17-5/h3-4H,1-2H3,(H,13,14)(H,15,16)