3-(ethylsulfonylmethyl)furan-2-carboxylic acid

Systemtic Name: 3-(ethylsulfonylmethyl)furan-2-carboxylic acid Openeye Name: 3-(ethylsulfonylmethyl)furan-2-carboxylic acid CAS Name: 3-(ethylsulfonylmethyl)-2-furancarboxylic acid IUPAC Name: 3-(ethylsulfonylmethyl)furan-2-carboxylic acid Traditional Name: 3-(esylmethyl)-2-furoic acid Formula: C8H10O5S MolecularWeight: 218.227

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)CC1=C(OC=C1)C(=O)O

Isomeric SMILES

CCS(=O)(=O)CC1=C(OC=C1)C(=O)O

InChI

InChI=1S/C8H10O5S/c1-2-14(11,12)5-6-3-4-13-7(6)8(9)10/h3-4H,2,5H2,1H3,(H,9,10)