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

Systemtic Name: (2S)-2-[5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-yl]-2-phenyl-ethanenitrile Openeye Name: (2S)-2-[5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-yl]-2-phenyl-acetonitrile CAS Name: (2S)-2-[5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-yl]-2-phenylacetonitrile IUPAC Name: (2S)-2-[5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-yl]-2-phenylacetonitrile Traditional Name: (2S)-2-[5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-yl]-2-phenyl-acetonitrile Formula: C18H9F6N3 MolecularWeight: 381.274579

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C#N)C2=NC3=C(C=C2)C(=CC(=N3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)[C@H](C#N)C2=NC3=C(C=C2)C(=CC(=N3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C18H9F6N3/c19-17(20,21)13-8-15(18(22,23)24)27-16-11(13)6-7-14(26-16)12(9-25)10-4-2-1-3-5-10/h1-8,12H/t12-/m0/s1