tert-butyl 6-[5-(3-bromanyl-5-fluoranyl-phenyl)-1,2,4-oxadiazol-3-yl]pyridine-3-carboxylate

Systemtic Name: tert-butyl 6-[5-(3-bromanyl-5-fluoranyl-phenyl)-1,2,4-oxadiazol-3-yl]pyridine-3-carboxylate Openeye Name: tert-butyl 6-[5-(3-bromo-5-fluoro-phenyl)-1,2,4-oxadiazol-3-yl]pyridine-3-carboxylate CAS Name: 6-[5-(3-bromo-5-fluorophenyl)-1,2,4-oxadiazol-3-yl]-3-pyridinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-[5-(3-bromo-5-fluorophenyl)-1,2,4-oxadiazol-3-yl]pyridine-3-carboxylate Traditional Name: 6-[5-(3-bromo-5-fluoro-phenyl)-1,2,4-oxadiazol-3-yl]nicotinic acid tert-butyl ester Formula: C18H15BrFN3O3 MolecularWeight: 420.232403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CN=C(C=C1)C2=NOC(=N2)C3=CC(=CC(=C3)Br)F

Isomeric SMILES

CC(C)(C)OC(=O)C1=CN=C(C=C1)C2=NOC(=N2)C3=CC(=CC(=C3)Br)F

InChI

InChI=1S/C18H15BrFN3O3/c1-18(2,3)25-17(24)10-4-5-14(21-9-10)15-22-16(26-23-15)11-6-12(19)8-13(20)7-11/h4-9H,1-3H3