2-[2-(4-bromanyl-2-fluoranyl-phenoxy)ethanoylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[2-(4-bromanyl-2-fluoranyl-phenoxy)ethanoylamino]-3-methyl-butanoic acid Openeye Name: 2-[[2-(4-bromo-2-fluoro-phenoxy)acetyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[2-(4-bromo-2-fluorophenoxy)-1-oxoethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-(4-bromo-2-fluorophenoxy)acetyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-(4-bromo-2-fluoro-phenoxy)acetyl]amino]-3-methyl-butyric acid Formula: C13H15BrFNO4 MolecularWeight: 348.164903

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)COC1=C(C=C(C=C1)Br)F

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)COC1=C(C=C(C=C1)Br)F

InChI

InChI=1S/C13H15BrFNO4/c1-7(2)12(13(18)19)16-11(17)6-20-10-4-3-8(14)5-9(10)15/h3-5,7,12H,6H2,1-2H3,(H,16,17)(H,18,19)