methyl 5-[(2-bromanyl-3-methyl-butanoyl)amino]-2,4-bis(fluoranyl)benzoate

Systemtic Name: methyl 5-[(2-bromanyl-3-methyl-butanoyl)amino]-2,4-bis(fluoranyl)benzoate Openeye Name: methyl 5-[(2-bromo-3-methyl-butanoyl)amino]-2,4-difluoro-benzoate CAS Name: 5-[(2-bromo-3-methyl-1-oxobutyl)amino]-2,4-difluorobenzoic acid methyl ester IUPAC Name: methyl 5-[(2-bromo-3-methylbutanoyl)amino]-2,4-difluorobenzoate Traditional Name: 5-[(2-bromo-3-methyl-butanoyl)amino]-2,4-difluoro-benzoic acid methyl ester Formula: C13H14BrF2NO3 MolecularWeight: 350.155966

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14BrF2NO3/c1-6(2)11(14)12(18)17-10-4-7(13(19)20-3)8(15)5-9(10)16/h4-6,11H,1-3H3,(H,17,18)