2-(4-tert-butylphenyl)-5-[(4-methyl-2-nitro-phenoxy)methyl]-1,3,4-oxadiazole

Systemtic Name: 2-(4-tert-butylphenyl)-5-[(4-methyl-2-nitro-phenoxy)methyl]-1,3,4-oxadiazole Openeye Name: 2-(4-tert-butylphenyl)-5-[(4-methyl-2-nitro-phenoxy)methyl]-1,3,4-oxadiazole CAS Name: 2-(4-tert-butylphenyl)-5-[(4-methyl-2-nitrophenoxy)methyl]-1,3,4-oxadiazole IUPAC Name: 2-(4-tert-butylphenyl)-5-[(4-methyl-2-nitrophenoxy)methyl]-1,3,4-oxadiazole Traditional Name: 2-(4-tert-butylphenyl)-5-[(4-methyl-2-nitro-phenoxy)methyl]-1,3,4-oxadiazole Formula: C20H21N3O4 MolecularWeight: 367.39844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC2=NN=C(O2)C3=CC=C(C=C3)C(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OCC2=NN=C(O2)C3=CC=C(C=C3)C(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O4/c1-13-5-10-17(16(11-13)23(24)25)26-12-18-21-22-19(27-18)14-6-8-15(9-7-14)20(2,3)4/h5-11H,12H2,1-4H3