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

Systemtic Name: 2-[3-(4-chlorophenyl)carbonyl-1,2-oxazol-5-yl]propanoic acid Openeye Name: 2-[3-(4-chlorobenzoyl)isoxazol-5-yl]propanoic acid CAS Name: 2-[3-[(4-chlorophenyl)-oxomethyl]-5-isoxazolyl]propanoic acid IUPAC Name: 2-[3-(4-chlorobenzoyl)-1,2-oxazol-5-yl]propanoic acid Traditional Name: 2-[3-(4-chlorobenzoyl)isoxazol-5-yl]propionic acid Formula: C13H10ClNO4 MolecularWeight: 279.6758

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=NO1)C(=O)C2=CC=C(C=C2)Cl)C(=O)O

Isomeric SMILES

CC(C1=CC(=NO1)C(=O)C2=CC=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C13H10ClNO4/c1-7(13(17)18)11-6-10(15-19-11)12(16)8-2-4-9(14)5-3-8/h2-7H,1H3,(H,17,18)