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

Systemtic Name: 3-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]propanoic acid Openeye Name: 3-[5-(4-methoxyphenyl)isoxazol-3-yl]propanoic acid CAS Name: 3-[5-(4-methoxyphenyl)-3-isoxazolyl]propanoic acid IUPAC Name: 3-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]propanoic acid Traditional Name: 3-[5-(4-methoxyphenyl)isoxazol-3-yl]propionic acid Formula: C13H13NO4 MolecularWeight: 247.24662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NO2)CCC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NO2)CCC(=O)O

InChI

InChI=1S/C13H13NO4/c1-17-11-5-2-9(3-6-11)12-8-10(14-18-12)4-7-13(15)16/h2-3,5-6,8H,4,7H2,1H3,(H,15,16)