methyl 4-[5-[4-(4-hexoxyphenyl)phenyl]-1,3,4-oxadiazol-2-yl]benzoate

Systemtic Name: methyl 4-[5-[4-(4-hexoxyphenyl)phenyl]-1,3,4-oxadiazol-2-yl]benzoate Openeye Name: methyl 4-[5-[4-(4-hexoxyphenyl)phenyl]-1,3,4-oxadiazol-2-yl]benzoate CAS Name: 4-[5-[4-(4-hexoxyphenyl)phenyl]-1,3,4-oxadiazol-2-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[5-[4-(4-hexoxyphenyl)phenyl]-1,3,4-oxadiazol-2-yl]benzoate Traditional Name: 4-[5-[4-(4-hexoxyphenyl)phenyl]-1,3,4-oxadiazol-2-yl]benzoic acid methyl ester Formula: C28H28N2O4 MolecularWeight: 456.53292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3=NN=C(O3)C4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3=NN=C(O3)C4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C28H28N2O4/c1-3-4-5-6-19-33-25-17-15-21(16-18-25)20-7-9-22(10-8-20)26-29-30-27(34-26)23-11-13-24(14-12-23)28(31)32-2/h7-18H,3-6,19H2,1-2H3