5-(4-heptoxyphenyl)-3-[4-(4-hexoxyphenyl)phenyl]-1,2,4-oxadiazole

Systemtic Name: 5-(4-heptoxyphenyl)-3-[4-(4-hexoxyphenyl)phenyl]-1,2,4-oxadiazole Openeye Name: 5-(4-heptoxyphenyl)-3-[4-(4-hexoxyphenyl)phenyl]-1,2,4-oxadiazole CAS Name: 5-(4-heptoxyphenyl)-3-[4-(4-hexoxyphenyl)phenyl]-1,2,4-oxadiazole IUPAC Name: 5-(4-heptoxyphenyl)-3-[4-(4-hexoxyphenyl)phenyl]-1,2,4-oxadiazole Traditional Name: 5-(4-heptoxyphenyl)-3-[4-(4-hexoxyphenyl)phenyl]-1,2,4-oxadiazole Formula: C33H40N2O3 MolecularWeight: 512.6823

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C2=NC(=NO2)C3=CC=C(C=C3)C4=CC=C(C=C4)OCCCCCC

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C2=NC(=NO2)C3=CC=C(C=C3)C4=CC=C(C=C4)OCCCCCC

InChI

InChI=1S/C33H40N2O3/c1-3-5-7-9-11-25-37-31-22-18-29(19-23-31)33-34-32(35-38-33)28-14-12-26(13-15-28)27-16-20-30(21-17-27)36-24-10-8-6-4-2/h12-23H,3-11,24-25H2,1-2H3