5-methylidene-4-oxidanylidene-thiane-3-carboxylic acid

Systemtic Name: 5-methylidene-4-oxidanylidene-thiane-3-carboxylic acid Openeye Name: 5-methylene-4-oxo-tetrahydrothiopyran-3-carboxylic acid CAS Name: 5-methylene-4-oxo-3-thianecarboxylic acid IUPAC Name: 5-methylidene-4-oxothiane-3-carboxylic acid Traditional Name: 4-keto-5-methylene-tetrahydrothiopyran-3-carboxylic acid Formula: C7H8O3S MolecularWeight: 172.20162

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Descriptors Computed from Structure

Canonical SMILES:

C=C1CSCC(C1=O)C(=O)O

Isomeric SMILES

C=C1CSCC(C1=O)C(=O)O

InChI

InChI=1S/C7H8O3S/c1-4-2-11-3-5(6(4)8)7(9)10/h5H,1-3H2,(H,9,10)