3-[4-[2-(4-tert-butylphenyl)ethynyl]phenyl]-2H-1,2,4-oxadiazol-5-one

Systemtic Name: 3-[4-[2-(4-tert-butylphenyl)ethynyl]phenyl]-2H-1,2,4-oxadiazol-5-one Openeye Name: 3-[4-[2-(4-tert-butylphenyl)ethynyl]phenyl]-2H-1,2,4-oxadiazol-5-one CAS Name: 3-[4-[2-(4-tert-butylphenyl)ethynyl]phenyl]-2H-1,2,4-oxadiazol-5-one IUPAC Name: 3-[4-[2-(4-tert-butylphenyl)ethynyl]phenyl]-2H-1,2,4-oxadiazol-5-one Traditional Name: 3-[4-[2-(4-tert-butylphenyl)ethynyl]phenyl]-2H-1,2,4-oxadiazol-5-one Formula: C20H18N2O2 MolecularWeight: 318.36912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C#CC2=CC=C(C=C2)C3=NC(=O)ON3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C#CC2=CC=C(C=C2)C3=NC(=O)ON3

InChI

InChI=1S/C20H18N2O2/c1-20(2,3)17-12-8-15(9-13-17)5-4-14-6-10-16(11-7-14)18-21-19(23)24-22-18/h6-13H,1-3H3,(H,21,22,23)