3-[(4-cyano-2-fluoranyl-phenyl)amino]butanoic acid

Systemtic Name: 3-[(4-cyano-2-fluoranyl-phenyl)amino]butanoic acid Openeye Name: 3-(4-cyano-2-fluoro-anilino)butanoic acid CAS Name: 3-(4-cyano-2-fluoroanilino)butanoic acid IUPAC Name: 3-(4-cyano-2-fluoroanilino)butanoic acid Traditional Name: 3-(4-cyano-2-fluoro-anilino)butyric acid Formula: C11H11FN2O2 MolecularWeight: 222.215643

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)NC1=C(C=C(C=C1)C#N)F

Isomeric SMILES

CC(CC(=O)O)NC1=C(C=C(C=C1)C#N)F

InChI

InChI=1S/C11H11FN2O2/c1-7(4-11(15)16)14-10-3-2-8(6-13)5-9(10)12/h2-3,5,7,14H,4H2,1H3,(H,15,16)