5-[(3-methoxy-3-oxidanylidene-propyl)sulfanylmethyl]furan-2-carboxylic acid

Systemtic Name: 5-[(3-methoxy-3-oxidanylidene-propyl)sulfanylmethyl]furan-2-carboxylic acid Openeye Name: 5-[(3-methoxy-3-oxo-propyl)sulfanylmethyl]furan-2-carboxylic acid CAS Name: 5-[[(3-methoxy-3-oxopropyl)thio]methyl]-2-furancarboxylic acid IUPAC Name: 5-[(3-methoxy-3-oxopropyl)sulfanylmethyl]furan-2-carboxylic acid Traditional Name: 5-[[(3-keto-3-methoxy-propyl)thio]methyl]-2-furoic acid Formula: C10H12O5S MolecularWeight: 244.26428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSCC1=CC=C(O1)C(=O)O

Isomeric SMILES

COC(=O)CCSCC1=CC=C(O1)C(=O)O

InChI

InChI=1S/C10H12O5S/c1-14-9(11)4-5-16-6-7-2-3-8(15-7)10(12)13/h2-3H,4-6H2,1H3,(H,12,13)