2-(4-tert-butylphenyl)-5-[4-(3,3-diethoxyprop-1-ynyl)phenyl]-1,3,4-oxadiazole

Systemtic Name: 2-(4-tert-butylphenyl)-5-[4-(3,3-diethoxyprop-1-ynyl)phenyl]-1,3,4-oxadiazole Openeye Name: 2-(4-tert-butylphenyl)-5-[4-(3,3-diethoxyprop-1-ynyl)phenyl]-1,3,4-oxadiazole CAS Name: 2-(4-tert-butylphenyl)-5-[4-(3,3-diethoxyprop-1-ynyl)phenyl]-1,3,4-oxadiazole IUPAC Name: 2-(4-tert-butylphenyl)-5-[4-(3,3-diethoxyprop-1-ynyl)phenyl]-1,3,4-oxadiazole Traditional Name: 2-(4-tert-butylphenyl)-5-[4-(3,3-diethoxyprop-1-ynyl)phenyl]-1,3,4-oxadiazole Formula: C25H28N2O3 MolecularWeight: 404.50142

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C#CC1=CC=C(C=C1)C2=NN=C(O2)C3=CC=C(C=C3)C(C)(C)C)OCC

Isomeric SMILES

CCOC(C#CC1=CC=C(C=C1)C2=NN=C(O2)C3=CC=C(C=C3)C(C)(C)C)OCC

InChI

InChI=1S/C25H28N2O3/c1-6-28-22(29-7-2)17-10-18-8-11-19(12-9-18)23-26-27-24(30-23)20-13-15-21(16-14-20)25(3,4)5/h8-9,11-16,22H,6-7H2,1-5H3