2-(4-hexadecoxyphenyl)-5-(2-methylphenyl)-1,3,4-oxadiazole

Systemtic Name: 2-(4-hexadecoxyphenyl)-5-(2-methylphenyl)-1,3,4-oxadiazole Openeye Name: 2-(4-hexadecoxyphenyl)-5-(o-tolyl)-1,3,4-oxadiazole CAS Name: 2-(4-hexadecoxyphenyl)-5-(2-methylphenyl)-1,3,4-oxadiazole IUPAC Name: 2-(4-hexadecoxyphenyl)-5-(2-methylphenyl)-1,3,4-oxadiazole Traditional Name: 2-(4-cetyloxyphenyl)-5-(o-tolyl)-1,3,4-oxadiazole Formula: C31H44N2O2 MolecularWeight: 476.69326

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C2=NN=C(O2)C3=CC=CC=C3C

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C2=NN=C(O2)C3=CC=CC=C3C

InChI

InChI=1S/C31H44N2O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-25-34-28-23-21-27(22-24-28)30-32-33-31(35-30)29-20-17-16-19-26(29)2/h16-17,19-24H,3-15,18,25H2,1-2H3