3-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]sulfanylpropanoic acid

Systemtic Name: 3-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]sulfanylpropanoic acid Openeye Name: 3-[(E)-3-hydroxy-3-oxo-prop-1-enyl]sulfanylpropanoic acid CAS Name: 3-[[(E)-3-hydroxy-3-oxoprop-1-enyl]thio]propanoic acid IUPAC Name: 3-[(E)-3-hydroxy-3-oxoprop-1-enyl]sulfanylpropanoic acid Traditional Name: 3-[[(E)-3-hydroxy-3-keto-prop-1-enyl]thio]propionic acid Formula: C6H8O4S MolecularWeight: 176.19032

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Descriptors Computed from Structure

Canonical SMILES:

C(CSC=CC(=O)O)C(=O)O

Isomeric SMILES

C(CS/C=C/C(=O)O)C(=O)O

InChI

InChI=1S/C6H8O4S/c7-5(8)1-3-11-4-2-6(9)10/h1,3H,2,4H2,(H,7,8)(H,9,10)/b3-1+