2-[(4-bromanyl-2-fluoranyl-phenyl)carbonylamino]hexanoic acid

Systemtic Name: 2-[(4-bromanyl-2-fluoranyl-phenyl)carbonylamino]hexanoic acid Openeye Name: 2-[(4-bromo-2-fluoro-benzoyl)amino]hexanoic acid CAS Name: 2-[[(4-bromo-2-fluorophenyl)-oxomethyl]amino]hexanoic acid IUPAC Name: 2-[(4-bromo-2-fluorobenzoyl)amino]hexanoic acid Traditional Name: 2-[(4-bromo-2-fluoro-benzoyl)amino]hexanoic acid Formula: C13H15BrFNO3 MolecularWeight: 332.165503

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)NC(=O)C1=C(C=C(C=C1)Br)F

Isomeric SMILES

CCCCC(C(=O)O)NC(=O)C1=C(C=C(C=C1)Br)F

InChI

InChI=1S/C13H15BrFNO3/c1-2-3-4-11(13(18)19)16-12(17)9-6-5-8(14)7-10(9)15/h5-7,11H,2-4H2,1H3,(H,16,17)(H,18,19)