5-(3-fluoranyl-4-octoxy-phenyl)-3-(4-nitrophenyl)-1,2,4-oxadiazole

Systemtic Name: 5-(3-fluoranyl-4-octoxy-phenyl)-3-(4-nitrophenyl)-1,2,4-oxadiazole Openeye Name: 5-(3-fluoro-4-octoxy-phenyl)-3-(4-nitrophenyl)-1,2,4-oxadiazole CAS Name: 5-(3-fluoro-4-octoxyphenyl)-3-(4-nitrophenyl)-1,2,4-oxadiazole IUPAC Name: 5-(3-fluoro-4-octoxyphenyl)-3-(4-nitrophenyl)-1,2,4-oxadiazole Traditional Name: 5-(3-fluoro-4-octoxy-phenyl)-3-(4-nitrophenyl)-1,2,4-oxadiazole Formula: C22H24FN3O4 MolecularWeight: 413.442063

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C=C1)C2=NC(=NO2)C3=CC=C(C=C3)[N+](=O)[O-])F

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C=C1)C2=NC(=NO2)C3=CC=C(C=C3)[N+](=O)[O-])F

InChI

InChI=1S/C22H24FN3O4/c1-2-3-4-5-6-7-14-29-20-13-10-17(15-19(20)23)22-24-21(25-30-22)16-8-11-18(12-9-16)26(27)28/h8-13,15H,2-7,14H2,1H3