5-(furan-2-ylmethylsulfanylmethyl)furan-2-carboxylic acid

Systemtic Name: 5-(furan-2-ylmethylsulfanylmethyl)furan-2-carboxylic acid Openeye Name: 5-(2-furylmethylsulfanylmethyl)furan-2-carboxylic acid CAS Name: 5-[(2-furanylmethylthio)methyl]-2-furancarboxylic acid IUPAC Name: 5-(furan-2-ylmethylsulfanylmethyl)furan-2-carboxylic acid Traditional Name: 5-[(2-furfurylthio)methyl]-2-furoic acid Formula: C11H10O4S MolecularWeight: 238.2597

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H10O4S/c12-11(13)10-4-3-9(15-10)7-16-6-8-2-1-5-14-8/h1-5H,6-7H2,(H,12,13)