2-[[2-cyano-4-(trifluoromethyl)phenyl]amino]propanoic acid

Systemtic Name: 2-[[2-cyano-4-(trifluoromethyl)phenyl]amino]propanoic acid Openeye Name: 2-[2-cyano-4-(trifluoromethyl)anilino]propanoic acid CAS Name: 2-[2-cyano-4-(trifluoromethyl)anilino]propanoic acid IUPAC Name: 2-[2-cyano-4-(trifluoromethyl)anilino]propanoic acid Traditional Name: 2-[2-cyano-4-(trifluoromethyl)anilino]propionic acid Formula: C11H9F3N2O2 MolecularWeight: 258.19657

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H9F3N2O2/c1-6(10(17)18)16-9-3-2-8(11(12,13)14)4-7(9)5-15/h2-4,6,16H,1H3,(H,17,18)