3-(4-bromophenyl)-2-(3-methyl-1,2-oxazol-5-yl)propanoic acid

Systemtic Name: 3-(4-bromophenyl)-2-(3-methyl-1,2-oxazol-5-yl)propanoic acid Openeye Name: 3-(4-bromophenyl)-2-(3-methylisoxazol-5-yl)propanoic acid CAS Name: 3-(4-bromophenyl)-2-(3-methyl-5-isoxazolyl)propanoic acid IUPAC Name: 3-(4-bromophenyl)-2-(3-methyl-1,2-oxazol-5-yl)propanoic acid Traditional Name: 3-(4-bromophenyl)-2-(3-methylisoxazol-5-yl)propionic acid Formula: C13H12BrNO3 MolecularWeight: 310.14328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)C(CC2=CC=C(C=C2)Br)C(=O)O

Isomeric SMILES

CC1=NOC(=C1)C(CC2=CC=C(C=C2)Br)C(=O)O

InChI

InChI=1S/C13H12BrNO3/c1-8-6-12(18-15-8)11(13(16)17)7-9-2-4-10(14)5-3-9/h2-6,11H,7H2,1H3,(H,16,17)