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

Systemtic Name: 3-[3-(4-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]propanoic acid Openeye Name: 3-[3-(4-chlorophenyl)-5-methyl-isoxazol-4-yl]propanoic acid CAS Name: 3-[3-(4-chlorophenyl)-5-methyl-4-isoxazolyl]propanoic acid IUPAC Name: 3-[3-(4-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]propanoic acid Traditional Name: 3-[3-(4-chlorophenyl)-5-methyl-isoxazol-4-yl]propionic acid Formula: C13H12ClNO3 MolecularWeight: 265.69228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=C(C=C2)Cl)CCC(=O)O

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=C(C=C2)Cl)CCC(=O)O

InChI

InChI=1S/C13H12ClNO3/c1-8-11(6-7-12(16)17)13(15-18-8)9-2-4-10(14)5-3-9/h2-5H,6-7H2,1H3,(H,16,17)