[1,3,4-tris(fluoranyl)-7-nitro-3,4-dihydro-1H-isoquinolin-2-yl] ethanoate

Systemtic Name: [1,3,4-tris(fluoranyl)-7-nitro-3,4-dihydro-1H-isoquinolin-2-yl] ethanoate Openeye Name: (1,3,4-trifluoro-7-nitro-3,4-dihydro-1H-isoquinolin-2-yl) acetate CAS Name: acetic acid (1,3,4-trifluoro-7-nitro-3,4-dihydro-1H-isoquinolin-2-yl) ester IUPAC Name: (1,3,4-trifluoro-7-nitro-3,4-dihydro-1H-isoquinolin-2-yl) acetate Traditional Name: acetic acid (1,3,4-trifluoro-7-nitro-3,4-dihydro-1H-isoquinolin-2-yl) ester Formula: C11H9F3N2O4 MolecularWeight: 290.19537

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)ON1C(C(C2=C(C1F)C=C(C=C2)[N+](=O)[O-])F)F

Isomeric SMILES

CC(=O)ON1C(C(C2=C(C1F)C=C(C=C2)[N+](=O)[O-])F)F

InChI

InChI=1S/C11H9F3N2O4/c1-5(17)20-15-10(13)8-4-6(16(18)19)2-3-7(8)9(12)11(15)14/h2-4,9-11H,1H3