2-phenylazanylpropanoic acid; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 2-phenylazanylpropanoic acid; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 2-anilinopropanoic acid; 2,2,2-trifluoroacetic acid CAS Name: 2-anilinopropanoic acid; 2,2,2-trifluoroacetic acid IUPAC Name: 2-anilinopropanoic acid; 2,2,2-trifluoroacetic acid Traditional Name: 2-anilinopropionic acid; 2,2,2-trifluoroacetic acid Formula: C11H12F3NO4 MolecularWeight: 279.21249

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC1=CC=CC=C1.C(=O)(C(F)(F)F)O

Isomeric SMILES

CC(C(=O)O)NC1=CC=CC=C1.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C9H11NO2.C2HF3O2/c1-7(9(11)12)10-8-5-3-2-4-6-8;3-2(4,5)1(6)7/h2-7,10H,1H3,(H,11,12);(H,6,7)