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

Systemtic Name: 5-[(3-methoxy-3-oxidanylidene-propyl)sulfanylmethyl]-2-methyl-furan-3-carboxylic acid Openeye Name: 5-[(3-methoxy-3-oxo-propyl)sulfanylmethyl]-2-methyl-furan-3-carboxylic acid CAS Name: 5-[[(3-methoxy-3-oxopropyl)thio]methyl]-2-methyl-3-furancarboxylic acid IUPAC Name: 5-[(3-methoxy-3-oxopropyl)sulfanylmethyl]-2-methylfuran-3-carboxylic acid Traditional Name: 5-[[(3-keto-3-methoxy-propyl)thio]methyl]-2-methyl-3-furoic acid Formula: C11H14O5S MolecularWeight: 258.29086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CSCCC(=O)OC)C(=O)O

Isomeric SMILES

CC1=C(C=C(O1)CSCCC(=O)OC)C(=O)O

InChI

InChI=1S/C11H14O5S/c1-7-9(11(13)14)5-8(16-7)6-17-4-3-10(12)15-2/h5H,3-4,6H2,1-2H3,(H,13,14)