2-(3,5-ditert-butylphenyl)-5-(3-prop-2-enoxyphenyl)-1,3,4-oxadiazole

Systemtic Name: 2-(3,5-ditert-butylphenyl)-5-(3-prop-2-enoxyphenyl)-1,3,4-oxadiazole Openeye Name: 2-(3-allyloxyphenyl)-5-(3,5-ditert-butylphenyl)-1,3,4-oxadiazole CAS Name: 2-(3,5-ditert-butylphenyl)-5-(3-prop-2-enoxyphenyl)-1,3,4-oxadiazole IUPAC Name: 2-(3,5-ditert-butylphenyl)-5-(3-prop-2-enoxyphenyl)-1,3,4-oxadiazole Traditional Name: 2-(3-allyloxyphenyl)-5-(3,5-ditert-butylphenyl)-1,3,4-oxadiazole Formula: C25H30N2O2 MolecularWeight: 390.5179

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)C2=NN=C(O2)C3=CC(=CC=C3)OCC=C)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)C2=NN=C(O2)C3=CC(=CC=C3)OCC=C)C(C)(C)C

InChI

InChI=1S/C25H30N2O2/c1-8-12-28-21-11-9-10-17(15-21)22-26-27-23(29-22)18-13-19(24(2,3)4)16-20(14-18)25(5,6)7/h8-11,13-16H,1,12H2,2-7H3