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

Systemtic Name: [1-oxidanylidene-1-[3-oxidanylidene-6-(trifluoromethyl)-2,4-dihydroquinoxalin-1-yl]propan-2-yl] 4-ethoxy-3-nitro-benzoate Openeye Name: [1-methyl-2-oxo-2-[3-oxo-6-(trifluoromethyl)-2,4-dihydroquinoxalin-1-yl]ethyl] 4-ethoxy-3-nitro-benzoate CAS Name: 4-ethoxy-3-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] 4-ethoxy-3-nitrobenzoate Traditional Name: 4-ethoxy-3-nitro-benzoic acid [2-keto-2-[3-keto-6-(trifluoromethyl)-2,4-dihydroquinoxalin-1-yl]-1-methyl-ethyl] ester Formula: C21H18F3N3O7 MolecularWeight: 481.37873

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)OC(C)C(=O)N2CC(=O)NC3=C2C=CC(=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)OC(C)C(=O)N2CC(=O)NC3=C2C=CC(=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C21H18F3N3O7/c1-3-33-17-7-4-12(8-16(17)27(31)32)20(30)34-11(2)19(29)26-10-18(28)25-14-9-13(21(22,23)24)5-6-15(14)26/h4-9,11H,3,10H2,1-2H3,(H,25,28)