4-(4-carboxy-1,3-oxazol-2-yl)-3-phenyl-butanoate

Systemtic Name: 4-(4-carboxy-1,3-oxazol-2-yl)-3-phenyl-butanoate Openeye Name: 4-(4-carboxyoxazol-2-yl)-3-phenyl-butanoate CAS Name: 4-(4-carboxy-2-oxazolyl)-3-phenylbutanoate IUPAC Name: 4-(4-carboxy-1,3-oxazol-2-yl)-3-phenylbutanoate Traditional Name: 4-(4-carboxyoxazol-2-yl)-3-phenyl-butyrate Formula: C14H12NO5- MolecularWeight: 274.24878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC2=NC(=CO2)C(=O)O)CC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(CC2=NC(=CO2)C(=O)O)CC(=O)[O-]

InChI

InChI=1S/C14H13NO5/c16-13(17)7-10(9-4-2-1-3-5-9)6-12-15-11(8-20-12)14(18)19/h1-5,8,10H,6-7H2,(H,16,17)(H,18,19)/p-1