3-[5-(4-nitrophenyl)-1,2-oxazol-4-yl]propanoic acid

Systemtic Name: 3-[5-(4-nitrophenyl)-1,2-oxazol-4-yl]propanoic acid Openeye Name: 3-[5-(4-nitrophenyl)isoxazol-4-yl]propanoic acid CAS Name: 3-[5-(4-nitrophenyl)-4-isoxazolyl]propanoic acid IUPAC Name: 3-[5-(4-nitrophenyl)-1,2-oxazol-4-yl]propanoic acid Traditional Name: 3-[5-(4-nitrophenyl)isoxazol-4-yl]propionic acid Formula: C12H10N2O5 MolecularWeight: 262.2182

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(C=NO2)CCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=C(C=NO2)CCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C12H10N2O5/c15-11(16)6-3-9-7-13-19-12(9)8-1-4-10(5-2-8)14(17)18/h1-2,4-5,7H,3,6H2,(H,15,16)