2-methyl-5-[[(2R)-1-oxidanyl-1-oxidanylidene-propan-2-yl]sulfanylmethyl]furan-3-carboxylic acid

Systemtic Name: 2-methyl-5-[[(2R)-1-oxidanyl-1-oxidanylidene-propan-2-yl]sulfanylmethyl]furan-3-carboxylic acid Openeye Name: 5-[[(1R)-2-hydroxy-1-methyl-2-oxo-ethyl]sulfanylmethyl]-2-methyl-furan-3-carboxylic acid CAS Name: 5-[[[(2R)-1-hydroxy-1-oxopropan-2-yl]thio]methyl]-2-methyl-3-furancarboxylic acid IUPAC Name: 5-[[(2R)-1-hydroxy-1-oxopropan-2-yl]sulfanylmethyl]-2-methylfuran-3-carboxylic acid Traditional Name: 5-[[[(1R)-2-hydroxy-2-keto-1-methyl-ethyl]thio]methyl]-2-methyl-3-furoic acid Formula: C10H12O5S MolecularWeight: 244.26428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CSC(C)C(=O)O)C(=O)O

Isomeric SMILES

CC1=C(C=C(O1)CS[C@H](C)C(=O)O)C(=O)O

InChI

InChI=1S/C10H12O5S/c1-5-8(10(13)14)3-7(15-5)4-16-6(2)9(11)12/h3,6H,4H2,1-2H3,(H,11,12)(H,13,14)/t6-/m1/s1