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

Systemtic Name: 2-acetamido-3-[4-(1,2-oxazol-5-yl)phenyl]propanoic acid Openeye Name: 2-acetamido-3-(4-isoxazol-5-ylphenyl)propanoic acid CAS Name: 2-acetamido-3-[4-(5-isoxazolyl)phenyl]propanoic acid IUPAC Name: 2-acetamido-3-[4-(1,2-oxazol-5-yl)phenyl]propanoic acid Traditional Name: 2-acetamido-3-(4-isoxazol-5-ylphenyl)propionic acid Formula: C14H14N2O4 MolecularWeight: 274.27196

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CC=C(C=C1)C2=CC=NO2)C(=O)O

Isomeric SMILES

CC(=O)NC(CC1=CC=C(C=C1)C2=CC=NO2)C(=O)O

InChI

InChI=1S/C14H14N2O4/c1-9(17)16-12(14(18)19)8-10-2-4-11(5-3-10)13-6-7-15-20-13/h2-7,12H,8H2,1H3,(H,16,17)(H,18,19)