2-(4-methoxyphenyl)-2-[3-(trifluoromethyl)quinoxalin-2-yl]ethanenitrile

Systemtic Name: 2-(4-methoxyphenyl)-2-[3-(trifluoromethyl)quinoxalin-2-yl]ethanenitrile Openeye Name: 2-(4-methoxyphenyl)-2-[3-(trifluoromethyl)quinoxalin-2-yl]acetonitrile CAS Name: 2-(4-methoxyphenyl)-2-[3-(trifluoromethyl)-2-quinoxalinyl]acetonitrile IUPAC Name: 2-(4-methoxyphenyl)-2-[3-(trifluoromethyl)quinoxalin-2-yl]acetonitrile Traditional Name: 2-(4-methoxyphenyl)-2-[3-(trifluoromethyl)quinoxalin-2-yl]acetonitrile Formula: C18H12F3N3O MolecularWeight: 343.30259

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C#N)C2=NC3=CC=CC=C3N=C2C(F)(F)F

Isomeric SMILES

COC1=CC=C(C=C1)C(C#N)C2=NC3=CC=CC=C3N=C2C(F)(F)F

InChI

InChI=1S/C18H12F3N3O/c1-25-12-8-6-11(7-9-12)13(10-22)16-17(18(19,20)21)24-15-5-3-2-4-14(15)23-16/h2-9,13H,1H3