6-chloranyl-7-[3,3,3-tris(fluoranyl)propanoyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-chloranyl-7-[3,3,3-tris(fluoranyl)propanoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-chloro-7-(3,3,3-trifluoropropanoyl)-4H-1,4-benzoxazin-3-one CAS Name: 6-chloro-7-(3,3,3-trifluoro-1-oxopropyl)-4H-1,4-benzoxazin-3-one IUPAC Name: 6-chloro-7-(3,3,3-trifluoropropanoyl)-4H-1,4-benzoxazin-3-one Traditional Name: 6-chloro-7-(3,3,3-trifluoropropanoyl)-4H-1,4-benzoxazin-3-one Formula: C11H7ClF3NO3 MolecularWeight: 293.62639

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(O1)C=C(C(=C2)Cl)C(=O)CC(F)(F)F

Isomeric SMILES

C1C(=O)NC2=C(O1)C=C(C(=C2)Cl)C(=O)CC(F)(F)F

InChI

InChI=1S/C11H7ClF3NO3/c12-6-2-7-9(19-4-10(18)16-7)1-5(6)8(17)3-11(13,14)15/h1-2H,3-4H2,(H,16,18)