3-(furan-2-ylmethylsulfanyl)-2-(furan-2-ylmethylsulfanylmethyl)-4-oxidanyl-5-oxidanylidene-furan-2-carboxylic acid

Systemtic Name: 3-(furan-2-ylmethylsulfanyl)-2-(furan-2-ylmethylsulfanylmethyl)-4-oxidanyl-5-oxidanylidene-furan-2-carboxylic acid Openeye Name: 3-(2-furylmethylsulfanyl)-2-(2-furylmethylsulfanylmethyl)-4-hydroxy-5-oxo-furan-2-carboxylic acid CAS Name: 3-(2-furanylmethylthio)-2-[(2-furanylmethylthio)methyl]-4-hydroxy-5-oxo-2-furancarboxylic acid IUPAC Name: 3-(furan-2-ylmethylsulfanyl)-2-(furan-2-ylmethylsulfanylmethyl)-4-hydroxy-5-oxofuran-2-carboxylic acid Traditional Name: 3-(2-furfurylthio)-2-[(2-furfurylthio)methyl]-4-hydroxy-5-keto-2-furoic acid Formula: C16H14O7S2 MolecularWeight: 382.40816

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CSCC2(C(=C(C(=O)O2)O)SCC3=CC=CO3)C(=O)O

Isomeric SMILES

C1=COC(=C1)CSCC2(C(=C(C(=O)O2)O)SCC3=CC=CO3)C(=O)O

InChI

InChI=1S/C16H14O7S2/c17-12-13(25-8-11-4-2-6-22-11)16(15(19)20,23-14(12)18)9-24-7-10-3-1-5-21-10/h1-6,17H,7-9H2,(H,19,20)