3-[2-(2-bromanyl-4-chloranyl-phenoxy)propanoylamino]propanoic acid

Systemtic Name: 3-[2-(2-bromanyl-4-chloranyl-phenoxy)propanoylamino]propanoic acid Openeye Name: 3-[2-(2-bromo-4-chloro-phenoxy)propanoylamino]propanoic acid CAS Name: 3-[[2-(2-bromo-4-chlorophenoxy)-1-oxopropyl]amino]propanoic acid IUPAC Name: 3-[2-(2-bromo-4-chlorophenoxy)propanoylamino]propanoic acid Traditional Name: 3-[2-(2-bromo-4-chloro-phenoxy)propanoylamino]propionic acid Formula: C12H13BrClNO4 MolecularWeight: 350.59292

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC(=O)O)OC1=C(C=C(C=C1)Cl)Br

Isomeric SMILES

CC(C(=O)NCCC(=O)O)OC1=C(C=C(C=C1)Cl)Br

InChI

InChI=1S/C12H13BrClNO4/c1-7(12(18)15-5-4-11(16)17)19-10-3-2-8(14)6-9(10)13/h2-3,6-7H,4-5H2,1H3,(H,15,18)(H,16,17)