2-[3-(4-bromophenyl)-5-fluoranyl-2,1-benzoxazol-7-yl]ethanenitrile

Systemtic Name: 2-[3-(4-bromophenyl)-5-fluoranyl-2,1-benzoxazol-7-yl]ethanenitrile Openeye Name: 2-[3-(4-bromophenyl)-5-fluoro-2,1-benzoxazol-7-yl]acetonitrile CAS Name: 2-[3-(4-bromophenyl)-5-fluoro-2,1-benzoxazol-7-yl]acetonitrile IUPAC Name: 2-[3-(4-bromophenyl)-5-fluoro-2,1-benzoxazol-7-yl]acetonitrile Traditional Name: 2-[3-(4-bromophenyl)-5-fluoro-anthranil-7-yl]acetonitrile Formula: C15H8BrFN2O MolecularWeight: 331.139223

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C3C=C(C=C(C3=NO2)CC#N)F)Br

Isomeric SMILES

C1=CC(=CC=C1C2=C3C=C(C=C(C3=NO2)CC#N)F)Br

InChI

InChI=1S/C15H8BrFN2O/c16-11-3-1-9(2-4-11)15-13-8-12(17)7-10(5-6-18)14(13)19-20-15/h1-4,7-8H,5H2