2-[(3-bromanyl-4-fluoranyl-phenyl)methylamino]ethanoic acid

Systemtic Name: 2-[(3-bromanyl-4-fluoranyl-phenyl)methylamino]ethanoic acid Openeye Name: 2-[(3-bromo-4-fluoro-phenyl)methylamino]acetic acid CAS Name: 2-[(3-bromo-4-fluorophenyl)methylamino]acetic acid IUPAC Name: 2-[(3-bromo-4-fluorophenyl)methylamino]acetic acid Traditional Name: 2-[(3-bromo-4-fluoro-benzyl)amino]acetic acid Formula: C9H9BrFNO2 MolecularWeight: 262.075663

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CNCC(=O)O)Br)F

Isomeric SMILES

C1=CC(=C(C=C1CNCC(=O)O)Br)F

InChI

InChI=1S/C9H9BrFNO2/c10-7-3-6(1-2-8(7)11)4-12-5-9(13)14/h1-3,12H,4-5H2,(H,13,14)