N-[3-[6-butoxy-4-(trifluoromethyl)pyridin-2-yl]oxypropyl]-2-fluoranyl-5-nitro-benzamide

Systemtic Name: N-[3-[6-butoxy-4-(trifluoromethyl)pyridin-2-yl]oxypropyl]-2-fluoranyl-5-nitro-benzamide Openeye Name: N-[3-[[6-butoxy-4-(trifluoromethyl)-2-pyridyl]oxy]propyl]-2-fluoro-5-nitro-benzamide CAS Name: N-[3-[[6-butoxy-4-(trifluoromethyl)-2-pyridinyl]oxy]propyl]-2-fluoro-5-nitrobenzamide IUPAC Name: N-[3-[6-butoxy-4-(trifluoromethyl)pyridin-2-yl]oxypropyl]-2-fluoro-5-nitrobenzamide Traditional Name: N-[3-[[6-butoxy-4-(trifluoromethyl)-2-pyridyl]oxy]propyl]-2-fluoro-5-nitro-benzamide Formula: C20H21F4N3O5 MolecularWeight: 459.391453

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NC(=CC(=C1)C(F)(F)F)OCCCNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])F

Isomeric SMILES

CCCCOC1=NC(=CC(=C1)C(F)(F)F)OCCCNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])F

InChI

InChI=1S/C20H21F4N3O5/c1-2-3-8-31-17-10-13(20(22,23)24)11-18(26-17)32-9-4-7-25-19(28)15-12-14(27(29)30)5-6-16(15)21/h5-6,10-12H,2-4,7-9H2,1H3,(H,25,28)