4-[(2-bromanyl-5-fluoranyl-phenyl)carbonyl-methyl-amino]butanoic acid

Systemtic Name: 4-[(2-bromanyl-5-fluoranyl-phenyl)carbonyl-methyl-amino]butanoic acid Openeye Name: 4-[(2-bromo-5-fluoro-benzoyl)-methyl-amino]butanoic acid CAS Name: 4-[[(2-bromo-5-fluorophenyl)-oxomethyl]-methylamino]butanoic acid IUPAC Name: 4-[(2-bromo-5-fluorobenzoyl)-methylamino]butanoic acid Traditional Name: 4-[(2-bromo-5-fluoro-benzoyl)-methyl-amino]butyric acid Formula: C12H13BrFNO3 MolecularWeight: 318.138923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13BrFNO3/c1-15(6-2-3-11(16)17)12(18)9-7-8(14)4-5-10(9)13/h4-5,7H,2-3,6H2,1H3,(H,16,17)