5-(2-cyano-3-fluoranyl-phenoxy)pentanoic acid

Systemtic Name: 5-(2-cyano-3-fluoranyl-phenoxy)pentanoic acid Openeye Name: 5-(2-cyano-3-fluoro-phenoxy)pentanoic acid CAS Name: 5-(2-cyano-3-fluorophenoxy)pentanoic acid IUPAC Name: 5-(2-cyano-3-fluorophenoxy)pentanoic acid Traditional Name: 5-(2-cyano-3-fluoro-phenoxy)valeric acid Formula: C12H12FNO3 MolecularWeight: 237.226983

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)F)C#N)OCCCCC(=O)O

Isomeric SMILES

C1=CC(=C(C(=C1)F)C#N)OCCCCC(=O)O

InChI

InChI=1S/C12H12FNO3/c13-10-4-3-5-11(9(10)8-14)17-7-2-1-6-12(15)16/h3-5H,1-2,6-7H2,(H,15,16)