2,2-dimethyl-3-oxidanylidene-4-[4-[6-(trifluoromethyl)quinoxalin-2-yl]oxyphenoxy]butanenitrile

Systemtic Name: 2,2-dimethyl-3-oxidanylidene-4-[4-[6-(trifluoromethyl)quinoxalin-2-yl]oxyphenoxy]butanenitrile Openeye Name: 2,2-dimethyl-3-oxo-4-[4-[6-(trifluoromethyl)quinoxalin-2-yl]oxyphenoxy]butanenitrile CAS Name: 2,2-dimethyl-3-oxo-4-[4-[[6-(trifluoromethyl)-2-quinoxalinyl]oxy]phenoxy]butanenitrile IUPAC Name: 2,2-dimethyl-3-oxo-4-[4-[6-(trifluoromethyl)quinoxalin-2-yl]oxyphenoxy]butanenitrile Traditional Name: 3-keto-2,2-dimethyl-4-[4-[6-(trifluoromethyl)quinoxalin-2-yl]oxyphenoxy]butyronitrile Formula: C21H16F3N3O3 MolecularWeight: 415.36525

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)C(=O)COC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)C(F)(F)F

Isomeric SMILES

CC(C)(C#N)C(=O)COC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)C(F)(F)F

InChI

InChI=1S/C21H16F3N3O3/c1-20(2,12-25)18(28)11-29-14-4-6-15(7-5-14)30-19-10-26-17-9-13(21(22,23)24)3-8-16(17)27-19/h3-10H,11H2,1-2H3