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

Systemtic Name: tert-butyl 6-[5-(3-bromophenyl)-1,2,4-oxadiazol-3-yl]pyridine-3-carboxylate Openeye Name: tert-butyl 6-[5-(3-bromophenyl)-1,2,4-oxadiazol-3-yl]pyridine-3-carboxylate CAS Name: 6-[5-(3-bromophenyl)-1,2,4-oxadiazol-3-yl]-3-pyridinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-[5-(3-bromophenyl)-1,2,4-oxadiazol-3-yl]pyridine-3-carboxylate Traditional Name: 6-[5-(3-bromophenyl)-1,2,4-oxadiazol-3-yl]nicotinic acid tert-butyl ester Formula: C18H16BrN3O3 MolecularWeight: 402.24194

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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

Isomeric SMILES

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

InChI

InChI=1S/C18H16BrN3O3/c1-18(2,3)24-17(23)12-7-8-14(20-10-12)15-21-16(25-22-15)11-5-4-6-13(19)9-11/h4-10H,1-3H3