7-nitro-3-(trifluoromethyl)-3,4-dihydro-2H-isoquinolin-1-one

Systemtic Name: 7-nitro-3-(trifluoromethyl)-3,4-dihydro-2H-isoquinolin-1-one Openeye Name: 7-nitro-3-(trifluoromethyl)-3,4-dihydro-2H-isoquinolin-1-one CAS Name: 7-nitro-3-(trifluoromethyl)-3,4-dihydro-2H-isoquinolin-1-one IUPAC Name: 7-nitro-3-(trifluoromethyl)-3,4-dihydro-2H-isoquinolin-1-one Traditional Name: 7-nitro-3-(trifluoromethyl)-3,4-dihydroisocarbostyril Formula: C10H7F3N2O3 MolecularWeight: 260.16939

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC(=O)C2=C1C=CC(=C2)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1C(NC(=O)C2=C1C=CC(=C2)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C10H7F3N2O3/c11-10(12,13)8-3-5-1-2-6(15(17)18)4-7(5)9(16)14-8/h1-2,4,8H,3H2,(H,14,16)