2-[(E)-2-(5-bromanyl-2-fluoranyl-phenyl)ethenyl]-5-phenyl-1,3-benzoxazole

Systemtic Name: 2-[(E)-2-(5-bromanyl-2-fluoranyl-phenyl)ethenyl]-5-phenyl-1,3-benzoxazole Openeye Name: 2-[(E)-2-(5-bromo-2-fluoro-phenyl)vinyl]-5-phenyl-1,3-benzoxazole CAS Name: 2-[(E)-2-(5-bromo-2-fluorophenyl)ethenyl]-5-phenyl-1,3-benzoxazole IUPAC Name: 2-[(E)-2-(5-bromo-2-fluorophenyl)ethenyl]-5-phenyl-1,3-benzoxazole Traditional Name: 2-[(E)-2-(5-bromo-2-fluoro-phenyl)vinyl]-5-phenyl-1,3-benzoxazole Formula: C21H13BrFNO MolecularWeight: 394.236423

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=C(C=C2)OC(=N3)C=CC4=C(C=CC(=C4)Br)F

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(C=C2)OC(=N3)/C=C/C4=C(C=CC(=C4)Br)F

InChI

InChI=1S/C21H13BrFNO/c22-17-8-9-18(23)16(12-17)7-11-21-24-19-13-15(6-10-20(19)25-21)14-4-2-1-3-5-14/h1-13H/b11-7+