2-[(2-bromanyl-5-fluoranyl-phenyl)carbonylamino]-2-methyl-pentanoic acid

Systemtic Name: 2-[(2-bromanyl-5-fluoranyl-phenyl)carbonylamino]-2-methyl-pentanoic acid Openeye Name: 2-[(2-bromo-5-fluoro-benzoyl)amino]-2-methyl-pentanoic acid CAS Name: 2-[[(2-bromo-5-fluorophenyl)-oxomethyl]amino]-2-methylpentanoic acid IUPAC Name: 2-[(2-bromo-5-fluorobenzoyl)amino]-2-methylpentanoic acid Traditional Name: 2-[(2-bromo-5-fluoro-benzoyl)amino]-2-methyl-valeric acid Formula: C13H15BrFNO3 MolecularWeight: 332.165503

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15BrFNO3/c1-3-6-13(2,12(18)19)16-11(17)9-7-8(15)4-5-10(9)14/h4-5,7H,3,6H2,1-2H3,(H,16,17)(H,18,19)