2-[[4-cyano-3-(trifluoromethyl)phenyl]-ethyl-amino]ethanoic acid

Systemtic Name: 2-[[4-cyano-3-(trifluoromethyl)phenyl]-ethyl-amino]ethanoic acid Openeye Name: 2-[4-cyano-N-ethyl-3-(trifluoromethyl)anilino]acetic acid CAS Name: 2-[4-cyano-N-ethyl-3-(trifluoromethyl)anilino]acetic acid IUPAC Name: 2-[4-cyano-N-ethyl-3-(trifluoromethyl)anilino]acetic acid Traditional Name: 2-[4-cyano-N-ethyl-3-(trifluoromethyl)anilino]acetic acid Formula: C12H11F3N2O2 MolecularWeight: 272.22315

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11F3N2O2/c1-2-17(7-11(18)19)9-4-3-8(6-16)10(5-9)12(13,14)15/h3-5H,2,7H2,1H3,(H,18,19)