butyl 2-[5-fluoranyl-4-[4-methyl-3-oxidanylidene-5-(trifluoromethyl)pyrazin-2-yl]-2-nitro-phenoxy]ethanoate

Systemtic Name: butyl 2-[5-fluoranyl-4-[4-methyl-3-oxidanylidene-5-(trifluoromethyl)pyrazin-2-yl]-2-nitro-phenoxy]ethanoate Openeye Name: butyl 2-[5-fluoro-4-[4-methyl-3-oxo-5-(trifluoromethyl)pyrazin-2-yl]-2-nitro-phenoxy]acetate CAS Name: 2-[5-fluoro-4-[4-methyl-3-oxo-5-(trifluoromethyl)-2-pyrazinyl]-2-nitrophenoxy]acetic acid butyl ester IUPAC Name: butyl 2-[5-fluoro-4-[4-methyl-3-oxo-5-(trifluoromethyl)pyrazin-2-yl]-2-nitrophenoxy]acetate Traditional Name: 2-[5-fluoro-4-[3-keto-4-methyl-5-(trifluoromethyl)pyrazin-2-yl]-2-nitro-phenoxy]acetic acid butyl ester Formula: C18H17F4N3O6 MolecularWeight: 447.337693

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17F4N3O6/c1-3-4-5-30-15(26)9-31-13-7-11(19)10(6-12(13)25(28)29)16-17(27)24(2)14(8-23-16)18(20,21)22/h6-8H,3-5,9H2,1-2H3