5-ethyl-4-(4-fluorophenyl)-3-(4-methylsulfonylphenyl)furan-2-carboxylic acid

Systemtic Name: 5-ethyl-4-(4-fluorophenyl)-3-(4-methylsulfonylphenyl)furan-2-carboxylic acid Openeye Name: 5-ethyl-4-(4-fluorophenyl)-3-(4-methylsulfonylphenyl)furan-2-carboxylic acid CAS Name: 5-ethyl-4-(4-fluorophenyl)-3-(4-methylsulfonylphenyl)-2-furancarboxylic acid IUPAC Name: 5-ethyl-4-(4-fluorophenyl)-3-(4-methylsulfonylphenyl)furan-2-carboxylic acid Traditional Name: 5-ethyl-4-(4-fluorophenyl)-3-(4-mesylphenyl)-2-furoic acid Formula: C20H17FO5S MolecularWeight: 388.409383

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(O1)C(=O)O)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=C(C=C3)F

Isomeric SMILES

CCC1=C(C(=C(O1)C(=O)O)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H17FO5S/c1-3-16-17(12-4-8-14(21)9-5-12)18(19(26-16)20(22)23)13-6-10-15(11-7-13)27(2,24)25/h4-11H,3H2,1-2H3,(H,22,23)