ethyl (E)-3-[2-[bis(fluoranyl)methoxy]-5-bromanyl-phenyl]-2-cyano-prop-2-enoate

Systemtic Name: ethyl (E)-3-[2-[bis(fluoranyl)methoxy]-5-bromanyl-phenyl]-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-3-[5-bromo-2-(difluoromethoxy)phenyl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[5-bromo-2-(difluoromethoxy)phenyl]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[5-bromo-2-(difluoromethoxy)phenyl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[5-bromo-2-(difluoromethoxy)phenyl]-2-cyano-acrylic acid ethyl ester Formula: C13H10BrF2NO3 MolecularWeight: 346.124206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=C(C=CC(=C1)Br)OC(F)F)C#N

Isomeric SMILES

CCOC(=O)/C(=C/C1=C(C=CC(=C1)Br)OC(F)F)/C#N

InChI

InChI=1S/C13H10BrF2NO3/c1-2-19-12(18)9(7-17)5-8-6-10(14)3-4-11(8)20-13(15)16/h3-6,13H,2H2,1H3/b9-5+