5-(3-fluoranyl-4-octoxy-phenyl)-3-(4-heptylphenyl)-1,2-oxazole

Systemtic Name: 5-(3-fluoranyl-4-octoxy-phenyl)-3-(4-heptylphenyl)-1,2-oxazole Openeye Name: 5-(3-fluoro-4-octoxy-phenyl)-3-(4-heptylphenyl)isoxazole CAS Name: 5-(3-fluoro-4-octoxyphenyl)-3-(4-heptylphenyl)isoxazole IUPAC Name: 5-(3-fluoro-4-octoxyphenyl)-3-(4-heptylphenyl)-1,2-oxazole Traditional Name: 5-(3-fluoro-4-octoxy-phenyl)-3-(4-heptylphenyl)isoxazole Formula: C30H40FNO2 MolecularWeight: 465.642503

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C=C1)C2=CC(=NO2)C3=CC=C(C=C3)CCCCCCC)F

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C=C1)C2=CC(=NO2)C3=CC=C(C=C3)CCCCCCC)F

InChI

InChI=1S/C30H40FNO2/c1-3-5-7-9-11-13-21-33-29-20-19-26(22-27(29)31)30-23-28(32-34-30)25-17-15-24(16-18-25)14-12-10-8-6-4-2/h15-20,22-23H,3-14,21H2,1-2H3