2-[[2-(1-bromanylpropoxy)-5-fluoranyl-phenyl]-ethanoyl-amino]ethanoic acid

Systemtic Name: 2-[[2-(1-bromanylpropoxy)-5-fluoranyl-phenyl]-ethanoyl-amino]ethanoic acid Openeye Name: 2-[N-acetyl-2-(1-bromopropoxy)-5-fluoro-anilino]acetic acid CAS Name: 2-[N-acetyl-2-(1-bromopropoxy)-5-fluoroanilino]acetic acid IUPAC Name: 2-[N-acetyl-2-(1-bromopropoxy)-5-fluoroanilino]acetic acid Traditional Name: 2-[N-acetyl-2-(1-bromopropoxy)-5-fluoro-anilino]acetic acid Formula: C13H15BrFNO4 MolecularWeight: 348.164903

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Descriptors Computed from Structure

Canonical SMILES:

CCC(OC1=C(C=C(C=C1)F)N(CC(=O)O)C(=O)C)Br

Isomeric SMILES

CCC(OC1=C(C=C(C=C1)F)N(CC(=O)O)C(=O)C)Br

InChI

InChI=1S/C13H15BrFNO4/c1-3-12(14)20-11-5-4-9(15)6-10(11)16(8(2)17)7-13(18)19/h4-6,12H,3,7H2,1-2H3,(H,18,19)