5-azanyl-4-[3,5-bis(trifluoromethyl)phenyl]furan-3-one

Systemtic Name: 5-azanyl-4-[3,5-bis(trifluoromethyl)phenyl]furan-3-one Openeye Name: 5-amino-4-[3,5-bis(trifluoromethyl)phenyl]furan-3-one CAS Name: 5-amino-4-[3,5-bis(trifluoromethyl)phenyl]-3-furanone IUPAC Name: 5-amino-4-[3,5-bis(trifluoromethyl)phenyl]furan-3-one Traditional Name: 5-amino-4-[3,5-bis(trifluoromethyl)phenyl]furan-3-one Formula: C12H7F6NO2 MolecularWeight: 311.179899

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)C(=C(O1)N)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1C(=O)C(=C(O1)N)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C12H7F6NO2/c13-11(14,15)6-1-5(2-7(3-6)12(16,17)18)9-8(20)4-21-10(9)19/h1-3H,4,19H2