2-[[6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-yl]-(2-oxidanidyl-2-oxidanylidene-ethyl)amino]ethanoate

Systemtic Name: 2-[[6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-yl]-(2-oxidanidyl-2-oxidanylidene-ethyl)amino]ethanoate Openeye Name: 2-[[6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-yl]-(2-oxido-2-oxo-ethyl)amino]acetate CAS Name: 2-[[6,7-dimethoxy-2-(trifluoromethyl)-4-quinazolinyl]-(2-oxido-2-oxoethyl)amino]acetate IUPAC Name: 2-[[6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-yl]-(2-oxido-2-oxoethyl)amino]acetate Traditional Name: 2-[[6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-yl]-(2-keto-2-oxido-ethyl)amino]acetate Formula: C15H12F3N3O6-2 MolecularWeight: 387.26749

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)C(F)(F)F)N(CC(=O)[O-])CC(=O)[O-])OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)C(F)(F)F)N(CC(=O)[O-])CC(=O)[O-])OC

InChI

InChI=1S/C15H14F3N3O6/c1-26-9-3-7-8(4-10(9)27-2)19-14(15(16,17)18)20-13(7)21(5-11(22)23)6-12(24)25/h3-4H,5-6H2,1-2H3,(H,22,23)(H,24,25)/p-2