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

Systemtic Name: 3-[(2-cyano-3-fluoranyl-phenoxy)methyl]furan-2-carboxylic acid Openeye Name: 3-[(2-cyano-3-fluoro-phenoxy)methyl]furan-2-carboxylic acid CAS Name: 3-[(2-cyano-3-fluorophenoxy)methyl]-2-furancarboxylic acid IUPAC Name: 3-[(2-cyano-3-fluorophenoxy)methyl]furan-2-carboxylic acid Traditional Name: 3-[(2-cyano-3-fluoro-phenoxy)methyl]-2-furoic acid Formula: C13H8FNO4 MolecularWeight: 261.205323

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)F)C#N)OCC2=C(OC=C2)C(=O)O

Isomeric SMILES

C1=CC(=C(C(=C1)F)C#N)OCC2=C(OC=C2)C(=O)O

InChI

InChI=1S/C13H8FNO4/c14-10-2-1-3-11(9(10)6-15)19-7-8-4-5-18-12(8)13(16)17/h1-5H,7H2,(H,16,17)