8-methoxy-6-oxidanyl-5-oxidanylidene-1,2-dihydro-3-benzothiepine-2-carboxylic acid

Systemtic Name: 8-methoxy-6-oxidanyl-5-oxidanylidene-1,2-dihydro-3-benzothiepine-2-carboxylic acid Openeye Name: 6-hydroxy-8-methoxy-5-oxo-1,2-dihydro-3-benzothiepine-2-carboxylic acid CAS Name: 6-hydroxy-8-methoxy-5-oxo-1,2-dihydro-3-benzothiepin-2-carboxylic acid IUPAC Name: 6-hydroxy-8-methoxy-5-oxo-1,2-dihydro-3-benzothiepine-2-carboxylic acid Traditional Name: 6-hydroxy-5-keto-8-methoxy-1,2-dihydro-3-benzothiepin-2-carboxylic acid Formula: C12H12O5S MolecularWeight: 268.28568

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C(=C1)CC(SCC2=O)C(=O)O)O

Isomeric SMILES

COC1=CC(=C2C(=C1)CC(SCC2=O)C(=O)O)O

InChI

InChI=1S/C12H12O5S/c1-17-7-2-6-3-10(12(15)16)18-5-9(14)11(6)8(13)4-7/h2,4,10,13H,3,5H2,1H3,(H,15,16)