(Z)-3-[3,5-bis(trifluoromethyl)phenyl]but-2-enal

Systemtic Name: (Z)-3-[3,5-bis(trifluoromethyl)phenyl]but-2-enal Openeye Name: (Z)-3-[3,5-bis(trifluoromethyl)phenyl]but-2-enal CAS Name: (Z)-3-[3,5-bis(trifluoromethyl)phenyl]-2-butenal IUPAC Name: (Z)-3-[3,5-bis(trifluoromethyl)phenyl]but-2-enal Traditional Name: (Z)-3-[3,5-bis(trifluoromethyl)phenyl]but-2-enal Formula: C12H8F6O MolecularWeight: 282.181739

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CC=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C/C(=C/C=O)/C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C12H8F6O/c1-7(2-3-19)8-4-9(11(13,14)15)6-10(5-8)12(16,17)18/h2-6H,1H3/b7-2-