1-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)ethyl 2-bromanyl-5-fluoranyl-benzoate

Systemtic Name: 1-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)ethyl 2-bromanyl-5-fluoranyl-benzoate Openeye Name: 1-[3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]ethyl 2-bromo-5-fluoro-benzoate CAS Name: 2-bromo-5-fluorobenzoic acid 1-[3-(3-pyridinyl)-1,2,4-oxadiazol-5-yl]ethyl ester IUPAC Name: 1-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)ethyl 2-bromo-5-fluorobenzoate Traditional Name: 2-bromo-5-fluoro-benzoic acid 1-[3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]ethyl ester Formula: C16H11BrFN3O3 MolecularWeight: 392.179243

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=NO1)C2=CN=CC=C2)OC(=O)C3=C(C=CC(=C3)F)Br

Isomeric SMILES

CC(C1=NC(=NO1)C2=CN=CC=C2)OC(=O)C3=C(C=CC(=C3)F)Br

InChI

InChI=1S/C16H11BrFN3O3/c1-9(23-16(22)12-7-11(18)4-5-13(12)17)15-20-14(21-24-15)10-3-2-6-19-8-10/h2-9H,1H3