2-azanyl-3-[5-(4-fluorophenyl)-3-oxidanylidene-1,2-oxazol-4-yl]propanoic acid

Systemtic Name: 2-azanyl-3-[5-(4-fluorophenyl)-3-oxidanylidene-1,2-oxazol-4-yl]propanoic acid Openeye Name: 2-amino-3-[5-(4-fluorophenyl)-3-oxo-isoxazol-4-yl]propanoic acid CAS Name: 2-amino-3-[5-(4-fluorophenyl)-3-oxo-4-isoxazolyl]propanoic acid IUPAC Name: 2-amino-3-[5-(4-fluorophenyl)-3-oxo-1,2-oxazol-4-yl]propanoic acid Traditional Name: 2-amino-3-[5-(4-fluorophenyl)-3-keto-4-isoxazolin-4-yl]propionic acid Formula: C12H11FN2O4 MolecularWeight: 266.225143

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(C(=O)NO2)CC(C(=O)O)N)F

Isomeric SMILES

C1=CC(=CC=C1C2=C(C(=O)NO2)CC(C(=O)O)N)F

InChI

InChI=1S/C12H11FN2O4/c13-7-3-1-6(2-4-7)10-8(11(16)15-19-10)5-9(14)12(17)18/h1-4,9H,5,14H2,(H,15,16)(H,17,18)