5-methoxy-1-oxidanylidene-isothiochromene-3-carboxylic acid

Systemtic Name: 5-methoxy-1-oxidanylidene-isothiochromene-3-carboxylic acid Openeye Name: 5-methoxy-1-oxo-isothiochromene-3-carboxylic acid CAS Name: 5-methoxy-1-oxo-2-benzothiopyran-3-carboxylic acid IUPAC Name: 5-methoxy-1-oxoisothiochromene-3-carboxylic acid Traditional Name: 1-keto-5-methoxy-isothiochromene-3-carboxylic acid Formula: C11H8O4S MolecularWeight: 236.24382

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1C=C(SC2=O)C(=O)O

Isomeric SMILES

COC1=CC=CC2=C1C=C(SC2=O)C(=O)O

InChI

InChI=1S/C11H8O4S/c1-15-8-4-2-3-6-7(8)5-9(10(12)13)16-11(6)14/h2-5H,1H3,(H,12,13)