3-[(2-cyano-3-fluoranyl-phenyl)amino]propanoic acid

Systemtic Name: 3-[(2-cyano-3-fluoranyl-phenyl)amino]propanoic acid Openeye Name: 3-(2-cyano-3-fluoro-anilino)propanoic acid CAS Name: 3-(2-cyano-3-fluoroanilino)propanoic acid IUPAC Name: 3-(2-cyano-3-fluoroanilino)propanoic acid Traditional Name: 3-(2-cyano-3-fluoro-anilino)propionic acid Formula: C10H9FN2O2 MolecularWeight: 208.189063

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H9FN2O2/c11-8-2-1-3-9(7(8)6-12)13-5-4-10(14)15/h1-3,13H,4-5H2,(H,14,15)