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

Systemtic Name: [1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl] 2-bromanyl-4-fluoranyl-benzoate Openeye Name: [2-(benzylamino)-1-methyl-2-oxo-ethyl] 2-bromo-4-fluoro-benzoate CAS Name: 2-bromo-4-fluorobenzoic acid [1-oxo-1-[(phenylmethyl)amino]propan-2-yl] ester IUPAC Name: [1-(benzylamino)-1-oxopropan-2-yl] 2-bromo-4-fluorobenzoate Traditional Name: 2-bromo-4-fluoro-benzoic acid [2-(benzylamino)-2-keto-1-methyl-ethyl] ester Formula: C17H15BrFNO3 MolecularWeight: 380.208303

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1)OC(=O)C2=C(C=C(C=C2)F)Br

Isomeric SMILES

CC(C(=O)NCC1=CC=CC=C1)OC(=O)C2=C(C=C(C=C2)F)Br

InChI

InChI=1S/C17H15BrFNO3/c1-11(16(21)20-10-12-5-3-2-4-6-12)23-17(22)14-8-7-13(19)9-15(14)18/h2-9,11H,10H2,1H3,(H,20,21)