4-[(2-carboxyfuran-3-yl)methylsulfanylmethyl]-5-methyl-furan-2-carboxylic acid

Systemtic Name: 4-[(2-carboxyfuran-3-yl)methylsulfanylmethyl]-5-methyl-furan-2-carboxylic acid Openeye Name: 4-[(2-carboxy-3-furyl)methylsulfanylmethyl]-5-methyl-furan-2-carboxylic acid CAS Name: 4-[[(2-carboxy-3-furanyl)methylthio]methyl]-5-methyl-2-furancarboxylic acid IUPAC Name: 4-[(2-carboxyfuran-3-yl)methylsulfanylmethyl]-5-methylfuran-2-carboxylic acid Traditional Name: 4-[[(2-carboxy-3-furyl)methylthio]methyl]-5-methyl-2-furoic acid Formula: C13H12O6S MolecularWeight: 296.29578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C(=O)O)CSCC2=C(OC=C2)C(=O)O

Isomeric SMILES

CC1=C(C=C(O1)C(=O)O)CSCC2=C(OC=C2)C(=O)O

InChI

InChI=1S/C13H12O6S/c1-7-9(4-10(19-7)12(14)15)6-20-5-8-2-3-18-11(8)13(16)17/h2-4H,5-6H2,1H3,(H,14,15)(H,16,17)