2-[[3-(trifluoromethyl)phenoxy]methyl]furan-3-carboxylic acid

Systemtic Name: 2-[[3-(trifluoromethyl)phenoxy]methyl]furan-3-carboxylic acid Openeye Name: 2-[[3-(trifluoromethyl)phenoxy]methyl]furan-3-carboxylic acid CAS Name: 2-[[3-(trifluoromethyl)phenoxy]methyl]-3-furancarboxylic acid IUPAC Name: 2-[[3-(trifluoromethyl)phenoxy]methyl]furan-3-carboxylic acid Traditional Name: 2-[[3-(trifluoromethyl)phenoxy]methyl]-3-furoic acid Formula: C13H9F3O4 MolecularWeight: 286.20337

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCC2=C(C=CO2)C(=O)O)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)OCC2=C(C=CO2)C(=O)O)C(F)(F)F

InChI

InChI=1S/C13H9F3O4/c14-13(15,16)8-2-1-3-9(6-8)20-7-11-10(12(17)18)4-5-19-11/h1-6H,7H2,(H,17,18)