3-[[4,6-bis(trifluoromethyl)pyridin-2-yl]amino]-2-[3-(trifluoromethyl)phenyl]carbonyl-prop-2-enenitrile

Systemtic Name: 3-[[4,6-bis(trifluoromethyl)pyridin-2-yl]amino]-2-[3-(trifluoromethyl)phenyl]carbonyl-prop-2-enenitrile Openeye Name: 3-[[4,6-bis(trifluoromethyl)-2-pyridyl]amino]-2-[3-(trifluoromethyl)benzoyl]prop-2-enenitrile CAS Name: 3-[[4,6-bis(trifluoromethyl)-2-pyridinyl]amino]-2-[oxo-[3-(trifluoromethyl)phenyl]methyl]-2-propenenitrile IUPAC Name: 3-[[4,6-bis(trifluoromethyl)pyridin-2-yl]amino]-2-[3-(trifluoromethyl)benzoyl]prop-2-enenitrile Traditional Name: 3-[[4,6-bis(trifluoromethyl)-2-pyridyl]amino]-2-[3-(trifluoromethyl)benzoyl]acrylonitrile Formula: C18H8F9N3O MolecularWeight: 453.261249

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)C(=O)C(=CNC2=CC(=CC(=N2)C(F)(F)F)C(F)(F)F)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)C(=O)C(=CNC2=CC(=CC(=N2)C(F)(F)F)C(F)(F)F)C#N

InChI

InChI=1S/C18H8F9N3O/c19-16(20,21)11-3-1-2-9(4-11)15(31)10(7-28)8-29-14-6-12(17(22,23)24)5-13(30-14)18(25,26)27/h1-6,8H,(H,29,30)