methyl 5-[(2-bromanyl-3-methyl-butanoyl)amino]-2-fluoranyl-benzoate

Systemtic Name: methyl 5-[(2-bromanyl-3-methyl-butanoyl)amino]-2-fluoranyl-benzoate Openeye Name: methyl 5-[(2-bromo-3-methyl-butanoyl)amino]-2-fluoro-benzoate CAS Name: 5-[(2-bromo-3-methyl-1-oxobutyl)amino]-2-fluorobenzoic acid methyl ester IUPAC Name: methyl 5-[(2-bromo-3-methylbutanoyl)amino]-2-fluorobenzoate Traditional Name: 5-[(2-bromo-3-methyl-butanoyl)amino]-2-fluoro-benzoic acid methyl ester Formula: C13H15BrFNO3 MolecularWeight: 332.165503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC(=C(C=C1)F)C(=O)OC)Br

Isomeric SMILES

CC(C)C(C(=O)NC1=CC(=C(C=C1)F)C(=O)OC)Br

InChI

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