4-[(3-bromanyl-5-fluoranyl-phenyl)carbonyl-methyl-amino]butanoic acid

Systemtic Name: 4-[(3-bromanyl-5-fluoranyl-phenyl)carbonyl-methyl-amino]butanoic acid Openeye Name: 4-[(3-bromo-5-fluoro-benzoyl)-methyl-amino]butanoic acid CAS Name: 4-[[(3-bromo-5-fluorophenyl)-oxomethyl]-methylamino]butanoic acid IUPAC Name: 4-[(3-bromo-5-fluorobenzoyl)-methylamino]butanoic acid Traditional Name: 4-[(3-bromo-5-fluoro-benzoyl)-methyl-amino]butyric acid Formula: C12H13BrFNO3 MolecularWeight: 318.138923

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)O)C(=O)C1=CC(=CC(=C1)Br)F

Isomeric SMILES

CN(CCCC(=O)O)C(=O)C1=CC(=CC(=C1)Br)F

InChI

InChI=1S/C12H13BrFNO3/c1-15(4-2-3-11(16)17)12(18)8-5-9(13)7-10(14)6-8/h5-7H,2-4H2,1H3,(H,16,17)