5-fluoranyl-N-(4-fluorophenyl)-2-[4-isocyano-3-(trifluoromethyl)phenyl]benzamide

Systemtic Name: 5-fluoranyl-N-(4-fluorophenyl)-2-[4-isocyano-3-(trifluoromethyl)phenyl]benzamide Openeye Name: 5-fluoro-N-(4-fluorophenyl)-2-[4-isocyano-3-(trifluoromethyl)phenyl]benzamide CAS Name: 5-fluoro-N-(4-fluorophenyl)-2-[4-isocyano-3-(trifluoromethyl)phenyl]benzamide IUPAC Name: 5-fluoro-N-(4-fluorophenyl)-2-[4-isocyano-3-(trifluoromethyl)phenyl]benzamide Traditional Name: 5-fluoro-N-(4-fluorophenyl)-2-[4-isocyano-3-(trifluoromethyl)phenyl]benzamide Formula: C21H11F5N2O MolecularWeight: 402.316856

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1=C(C=C(C=C1)C2=C(C=C(C=C2)F)C(=O)NC3=CC=C(C=C3)F)C(F)(F)F

Isomeric SMILES

[C-]#[N+]C1=C(C=C(C=C1)C2=C(C=C(C=C2)F)C(=O)NC3=CC=C(C=C3)F)C(F)(F)F

InChI

InChI=1S/C21H11F5N2O/c1-27-19-9-2-12(10-18(19)21(24,25)26)16-8-5-14(23)11-17(16)20(29)28-15-6-3-13(22)4-7-15/h2-11H,(H,28,29)