(2-cyanophenyl)methyl (E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoate

Systemtic Name: (2-cyanophenyl)methyl (E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoate Openeye Name: (2-cyanophenyl)methyl (E)-3-(5-bromo-2-fluoro-phenyl)prop-2-enoate CAS Name: (E)-3-(5-bromo-2-fluorophenyl)-2-propenoic acid (2-cyanophenyl)methyl ester IUPAC Name: (2-cyanophenyl)methyl (E)-3-(5-bromo-2-fluorophenyl)prop-2-enoate Traditional Name: (E)-3-(5-bromo-2-fluoro-phenyl)acrylic acid (2-cyanobenzyl) ester Formula: C17H11BrFNO2 MolecularWeight: 360.177143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC(=O)C=CC2=C(C=CC(=C2)Br)F)C#N

Isomeric SMILES

C1=CC=C(C(=C1)COC(=O)/C=C/C2=C(C=CC(=C2)Br)F)C#N

InChI

InChI=1S/C17H11BrFNO2/c18-15-6-7-16(19)12(9-15)5-8-17(21)22-11-14-4-2-1-3-13(14)10-20/h1-9H,11H2/b8-5+