3-isoquinolin-5-yl-5-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,2,4-oxadiazole

Systemtic Name: 3-isoquinolin-5-yl-5-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,2,4-oxadiazole Openeye Name: 5-(4-tert-butoxyphenyl)-3-(5-isoquinolyl)-1,2,4-oxadiazole CAS Name: 3-(5-isoquinolinyl)-5-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,2,4-oxadiazole IUPAC Name: 3-isoquinolin-5-yl-5-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,2,4-oxadiazole Traditional Name: 5-(4-tert-butoxyphenyl)-3-(5-isoquinolyl)-1,2,4-oxadiazole Formula: C21H19N3O2 MolecularWeight: 345.39446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC1=CC=C(C=C1)C2=NC(=NO2)C3=CC=CC4=C3C=CN=C4

Isomeric SMILES

CC(C)(C)OC1=CC=C(C=C1)C2=NC(=NO2)C3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C21H19N3O2/c1-21(2,3)25-16-9-7-14(8-10-16)20-23-19(24-26-20)18-6-4-5-15-13-22-12-11-17(15)18/h4-13H,1-3H3