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

Systemtic Name: 5-fluoranyl-2-[4-isocyano-3-(trifluoromethyl)phenyl]-N,N-dipropyl-benzamide Openeye Name: 5-fluoro-2-[4-isocyano-3-(trifluoromethyl)phenyl]-N,N-dipropyl-benzamide CAS Name: 5-fluoro-2-[4-isocyano-3-(trifluoromethyl)phenyl]-N,N-dipropylbenzamide IUPAC Name: 5-fluoro-2-[4-isocyano-3-(trifluoromethyl)phenyl]-N,N-dipropylbenzamide Traditional Name: 5-fluoro-2-[4-isocyano-3-(trifluoromethyl)phenyl]-N,N-dipropyl-benzamide Formula: C21H20F4N2O MolecularWeight: 392.389913

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)C1=C(C=CC(=C1)F)C2=CC(=C(C=C2)[N+]#[C-])C(F)(F)F

Isomeric SMILES

CCCN(CCC)C(=O)C1=C(C=CC(=C1)F)C2=CC(=C(C=C2)[N+]#[C-])C(F)(F)F

InChI

InChI=1S/C21H20F4N2O/c1-4-10-27(11-5-2)20(28)17-13-15(22)7-8-16(17)14-6-9-19(26-3)18(12-14)21(23,24)25/h6-9,12-13H,4-5,10-11H2,1-2H3