(3-phenyl-1,2,4-oxadiazol-5-yl)methyl (E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoate

Systemtic Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl (E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoate Openeye Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl (E)-3-(5-bromo-2-fluoro-phenyl)prop-2-enoate CAS Name: (E)-3-(5-bromo-2-fluorophenyl)-2-propenoic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl (E)-3-(5-bromo-2-fluorophenyl)prop-2-enoate Traditional Name: (E)-3-(5-bromo-2-fluoro-phenyl)acrylic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C18H12BrFN2O3 MolecularWeight: 403.201883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NOC(=N2)COC(=O)C=CC3=C(C=CC(=C3)Br)F

Isomeric SMILES

C1=CC=C(C=C1)C2=NOC(=N2)COC(=O)/C=C/C3=C(C=CC(=C3)Br)F

InChI

InChI=1S/C18H12BrFN2O3/c19-14-7-8-15(20)13(10-14)6-9-17(23)24-11-16-21-18(22-25-16)12-4-2-1-3-5-12/h1-10H,11H2/b9-6+