2-[5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-yl]-2-(4-nitrophenyl)ethanenitrile

Systemtic Name: 2-[5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-yl]-2-(4-nitrophenyl)ethanenitrile Openeye Name: 2-[5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-yl]-2-(4-nitrophenyl)acetonitrile CAS Name: 2-[5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-yl]-2-(4-nitrophenyl)acetonitrile IUPAC Name: 2-[5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-yl]-2-(4-nitrophenyl)acetonitrile Traditional Name: 2-[5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-yl]-2-(4-nitrophenyl)acetonitrile Formula: C18H8F6N4O2 MolecularWeight: 426.272139

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(C#N)C2=NC3=C(C=C2)C(=CC(=N3)C(F)(F)F)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(C#N)C2=NC3=C(C=C2)C(=CC(=N3)C(F)(F)F)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C18H8F6N4O2/c19-17(20,21)13-7-15(18(22,23)24)27-16-11(13)5-6-14(26-16)12(8-25)9-1-3-10(4-2-9)28(29)30/h1-7,12H