3-[(4-bromanyl-2-fluoranyl-phenyl)-ethyl-amino]propanoic acid

Systemtic Name: 3-[(4-bromanyl-2-fluoranyl-phenyl)-ethyl-amino]propanoic acid Openeye Name: 3-(4-bromo-N-ethyl-2-fluoro-anilino)propanoic acid CAS Name: 3-(4-bromo-N-ethyl-2-fluoroanilino)propanoic acid IUPAC Name: 3-(4-bromo-N-ethyl-2-fluoroanilino)propanoic acid Traditional Name: 3-(4-bromo-N-ethyl-2-fluoro-anilino)propionic acid Formula: C11H13BrFNO2 MolecularWeight: 290.128823

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCC(=O)O)C1=C(C=C(C=C1)Br)F

Isomeric SMILES

CCN(CCC(=O)O)C1=C(C=C(C=C1)Br)F

InChI

InChI=1S/C11H13BrFNO2/c1-2-14(6-5-11(15)16)10-4-3-8(12)7-9(10)13/h3-4,7H,2,5-6H2,1H3,(H,15,16)