3-[3,5-bis(trifluoromethyl)phenyl]-N-methyl-3-oxidanylidene-propan-1-imine oxide

Systemtic Name: 3-[3,5-bis(trifluoromethyl)phenyl]-N-methyl-3-oxidanylidene-propan-1-imine oxide Openeye Name: 3-[3,5-bis(trifluoromethyl)phenyl]-N-methyl-3-oxo-propan-1-imine oxide CAS Name: 3-[3,5-bis(trifluoromethyl)phenyl]-N-methyl-3-oxo-1-propanimine oxide IUPAC Name: 3-[3,5-bis(trifluoromethyl)phenyl]-N-methyl-3-oxopropan-1-imine oxide Traditional Name: 3-[3,5-bis(trifluoromethyl)phenyl]-3-keto-N-methyl-propan-1-imine oxide Formula: C12H9F6NO2 MolecularWeight: 313.195779

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](=CCC(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)[O-]

Isomeric SMILES

C/[N+](=C/CC(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)/[O-]

InChI

InChI=1S/C12H9F6NO2/c1-19(21)3-2-10(20)7-4-8(11(13,14)15)6-9(5-7)12(16,17)18/h3-6H,2H2,1H3/b19-3-