2-methyl-5-[4-methyl-2,5-bis(3,5,5-trimethylhexoxy)phenyl]-1,3,4-oxadiazole

Systemtic Name: 2-methyl-5-[4-methyl-2,5-bis(3,5,5-trimethylhexoxy)phenyl]-1,3,4-oxadiazole Openeye Name: 2-methyl-5-[4-methyl-2,5-bis(3,5,5-trimethylhexoxy)phenyl]-1,3,4-oxadiazole CAS Name: 2-methyl-5-[4-methyl-2,5-bis(3,5,5-trimethylhexoxy)phenyl]-1,3,4-oxadiazole IUPAC Name: 2-methyl-5-[4-methyl-2,5-bis(3,5,5-trimethylhexoxy)phenyl]-1,3,4-oxadiazole Traditional Name: 2-methyl-5-[4-methyl-2,5-bis(3,5,5-trimethylhexoxy)phenyl]-1,3,4-oxadiazole Formula: C28H46N2O3 MolecularWeight: 458.67644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)OCCC(C)CC(C)(C)C)C2=NN=C(O2)C)OCCC(C)CC(C)(C)C

Isomeric SMILES

CC1=C(C=C(C(=C1)OCCC(C)CC(C)(C)C)C2=NN=C(O2)C)OCCC(C)CC(C)(C)C

InChI

InChI=1S/C28H46N2O3/c1-19(17-27(5,6)7)11-13-31-24-16-23(26-30-29-22(4)33-26)25(15-21(24)3)32-14-12-20(2)18-28(8,9)10/h15-16,19-20H,11-14,17-18H2,1-10H3