3-(ethylsulfanylmethyl)furan-2-carboxylic acid

Systemtic Name: 3-(ethylsulfanylmethyl)furan-2-carboxylic acid Openeye Name: 3-(ethylsulfanylmethyl)furan-2-carboxylic acid CAS Name: 3-[(ethylthio)methyl]-2-furancarboxylic acid IUPAC Name: 3-(ethylsulfanylmethyl)furan-2-carboxylic acid Traditional Name: 3-[(ethylthio)methyl]-2-furoic acid Formula: C8H10O3S MolecularWeight: 186.2282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSCC1=C(OC=C1)C(=O)O

Isomeric SMILES

CCSCC1=C(OC=C1)C(=O)O

InChI

InChI=1S/C8H10O3S/c1-2-12-5-6-3-4-11-7(6)8(9)10/h3-4H,2,5H2,1H3,(H,9,10)