[1-oxidanylidene-1-[3-oxidanylidene-6-(trifluoromethyl)-2,4-dihydroquinoxalin-1-yl]propan-2-yl] 2-methyl-6-nitro-benzoate

Systemtic Name: [1-oxidanylidene-1-[3-oxidanylidene-6-(trifluoromethyl)-2,4-dihydroquinoxalin-1-yl]propan-2-yl] 2-methyl-6-nitro-benzoate Openeye Name: [1-methyl-2-oxo-2-[3-oxo-6-(trifluoromethyl)-2,4-dihydroquinoxalin-1-yl]ethyl] 2-methyl-6-nitro-benzoate CAS Name: 2-methyl-6-nitrobenzoic acid [1-oxo-1-[3-oxo-6-(trifluoromethyl)-2,4-dihydroquinoxalin-1-yl]propan-2-yl] ester IUPAC Name: [1-oxo-1-[3-oxo-6-(trifluoromethyl)-2,4-dihydroquinoxalin-1-yl]propan-2-yl] 2-methyl-6-nitrobenzoate Traditional Name: 2-methyl-6-nitro-benzoic acid [2-keto-2-[3-keto-6-(trifluoromethyl)-2,4-dihydroquinoxalin-1-yl]-1-methyl-ethyl] ester Formula: C20H16F3N3O6 MolecularWeight: 451.35275

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)[N+](=O)[O-])C(=O)OC(C)C(=O)N2CC(=O)NC3=C2C=CC(=C3)C(F)(F)F

Isomeric SMILES

CC1=C(C(=CC=C1)[N+](=O)[O-])C(=O)OC(C)C(=O)N2CC(=O)NC3=C2C=CC(=C3)C(F)(F)F

InChI

InChI=1S/C20H16F3N3O6/c1-10-4-3-5-15(26(30)31)17(10)19(29)32-11(2)18(28)25-9-16(27)24-13-8-12(20(21,22)23)6-7-14(13)25/h3-8,11H,9H2,1-2H3,(H,24,27)