(5,7-dinitroquinolin-8-yl) 2,2,2-tris(fluoranyl)ethanoate

Systemtic Name: (5,7-dinitroquinolin-8-yl) 2,2,2-tris(fluoranyl)ethanoate Openeye Name: (5,7-dinitro-8-quinolyl) 2,2,2-trifluoroacetate CAS Name: 2,2,2-trifluoroacetic acid (5,7-dinitro-8-quinolinyl) ester IUPAC Name: (5,7-dinitroquinolin-8-yl) 2,2,2-trifluoroacetate Traditional Name: 2,2,2-trifluoroacetic acid (5,7-dinitro-8-quinolyl) ester Formula: C11H4F3N3O6 MolecularWeight: 331.16117

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])OC(=O)C(F)(F)F)N=C1

Isomeric SMILES

C1=CC2=C(C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])OC(=O)C(F)(F)F)N=C1

InChI

InChI=1S/C11H4F3N3O6/c12-11(13,14)10(18)23-9-7(17(21)22)4-6(16(19)20)5-2-1-3-15-8(5)9/h1-4H