5-butyl-2-(3-fluoranyl-4-octoxy-phenyl)-1,3-benzoxazole

Systemtic Name: 5-butyl-2-(3-fluoranyl-4-octoxy-phenyl)-1,3-benzoxazole Openeye Name: 5-butyl-2-(3-fluoro-4-octoxy-phenyl)-1,3-benzoxazole CAS Name: 5-butyl-2-(3-fluoro-4-octoxyphenyl)-1,3-benzoxazole IUPAC Name: 5-butyl-2-(3-fluoro-4-octoxyphenyl)-1,3-benzoxazole Traditional Name: 5-butyl-2-(3-fluoro-4-octoxy-phenyl)-1,3-benzoxazole Formula: C25H32FNO2 MolecularWeight: 397.525483

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)CCCC)F

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)CCCC)F

InChI

InChI=1S/C25H32FNO2/c1-3-5-7-8-9-10-16-28-23-15-13-20(18-21(23)26)25-27-22-17-19(11-6-4-2)12-14-24(22)29-25/h12-15,17-18H,3-11,16H2,1-2H3