butyl 2-[4-[5-ethyl-6-oxidanylidene-4-(trifluoromethyl)pyrimidin-1-yl]-5-fluoranyl-2-nitro-phenoxy]ethanoate

Systemtic Name: butyl 2-[4-[5-ethyl-6-oxidanylidene-4-(trifluoromethyl)pyrimidin-1-yl]-5-fluoranyl-2-nitro-phenoxy]ethanoate Openeye Name: butyl 2-[4-[5-ethyl-6-oxo-4-(trifluoromethyl)pyrimidin-1-yl]-5-fluoro-2-nitro-phenoxy]acetate CAS Name: 2-[4-[5-ethyl-6-oxo-4-(trifluoromethyl)-1-pyrimidinyl]-5-fluoro-2-nitrophenoxy]acetic acid butyl ester IUPAC Name: butyl 2-[4-[5-ethyl-6-oxo-4-(trifluoromethyl)pyrimidin-1-yl]-5-fluoro-2-nitrophenoxy]acetate Traditional Name: 2-[4-[5-ethyl-6-keto-4-(trifluoromethyl)pyrimidin-1-yl]-5-fluoro-2-nitro-phenoxy]acetic acid butyl ester Formula: C19H19F4N3O6 MolecularWeight: 461.364273

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)COC1=C(C=C(C(=C1)F)N2C=NC(=C(C2=O)CC)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCCCOC(=O)COC1=C(C=C(C(=C1)F)N2C=NC(=C(C2=O)CC)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C19H19F4N3O6/c1-3-5-6-31-16(27)9-32-15-7-12(20)13(8-14(15)26(29)30)25-10-24-17(19(21,22)23)11(4-2)18(25)28/h7-8,10H,3-6,9H2,1-2H3