methyl 2-[(5-bromanyl-2-fluoranyl-phenyl)carbonylamino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[(5-bromanyl-2-fluoranyl-phenyl)carbonylamino]-4-methyl-pentanoate Openeye Name: methyl 2-[(5-bromo-2-fluoro-benzoyl)amino]-4-methyl-pentanoate CAS Name: 2-[[(5-bromo-2-fluorophenyl)-oxomethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[(5-bromo-2-fluorobenzoyl)amino]-4-methylpentanoate Traditional Name: 2-[(5-bromo-2-fluoro-benzoyl)amino]-4-methyl-valeric acid methyl ester Formula: C14H17BrFNO3 MolecularWeight: 346.192083

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17BrFNO3/c1-8(2)6-12(14(19)20-3)17-13(18)10-7-9(15)4-5-11(10)16/h4-5,7-8,12H,6H2,1-3H3,(H,17,18)