2-azanyl-3-naphthalen-1-yl-propanoic acid; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 2-azanyl-3-naphthalen-1-yl-propanoic acid; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 2-amino-3-(1-naphthyl)propanoic acid; 2,2,2-trifluoroacetic acid CAS Name: 2-amino-3-(1-naphthalenyl)propanoic acid; 2,2,2-trifluoroacetic acid IUPAC Name: 2-amino-3-naphthalen-1-ylpropanoic acid; 2,2,2-trifluoroacetic acid Traditional Name: 2-amino-3-(1-naphthyl)propionic acid; 2,2,2-trifluoroacetic acid Formula: C15H14F3NO4 MolecularWeight: 329.27117

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CC(C(=O)O)N.C(=O)(C(F)(F)F)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CC(C(=O)O)N.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C13H13NO2.C2HF3O2/c14-12(13(15)16)8-10-6-3-5-9-4-1-2-7-11(9)10;3-2(4,5)1(6)7/h1-7,12H,8,14H2,(H,15,16);(H,6,7)