2-azanyl-3-[4-(5-cyano-2-fluoranyl-phenyl)phenyl]propanoic acid

Systemtic Name: 2-azanyl-3-[4-(5-cyano-2-fluoranyl-phenyl)phenyl]propanoic acid Openeye Name: 2-amino-3-[4-(5-cyano-2-fluoro-phenyl)phenyl]propanoic acid CAS Name: 2-amino-3-[4-(5-cyano-2-fluorophenyl)phenyl]propanoic acid IUPAC Name: 2-amino-3-[4-(5-cyano-2-fluorophenyl)phenyl]propanoic acid Traditional Name: 2-amino-3-[4-(5-cyano-2-fluoro-phenyl)phenyl]propionic acid Formula: C16H13FN2O2 MolecularWeight: 284.285023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)O)N)C2=C(C=CC(=C2)C#N)F

Isomeric SMILES

C1=CC(=CC=C1CC(C(=O)O)N)C2=C(C=CC(=C2)C#N)F

InChI

InChI=1S/C16H13FN2O2/c17-14-6-3-11(9-18)7-13(14)12-4-1-10(2-5-12)8-15(19)16(20)21/h1-7,15H,8,19H2,(H,20,21)