[1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] 4-bromanyl-2-fluoranyl-benzoate

Systemtic Name: [1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] 4-bromanyl-2-fluoranyl-benzoate Openeye Name: [2-(isobutylamino)-1-methyl-2-oxo-ethyl] 4-bromo-2-fluoro-benzoate CAS Name: 4-bromo-2-fluorobenzoic acid [1-(2-methylpropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-methylpropylamino)-1-oxopropan-2-yl] 4-bromo-2-fluorobenzoate Traditional Name: 4-bromo-2-fluoro-benzoic acid [2-(isobutylamino)-2-keto-1-methyl-ethyl] ester Formula: C14H17BrFNO3 MolecularWeight: 346.192083

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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