3-[[3-oxidanylidene-6-(trifluoromethyl)-2,4-dihydroquinoxalin-1-yl]carbonyl]benzenecarbonitrile

Systemtic Name: 3-[[3-oxidanylidene-6-(trifluoromethyl)-2,4-dihydroquinoxalin-1-yl]carbonyl]benzenecarbonitrile Openeye Name: 3-[3-oxo-6-(trifluoromethyl)-2,4-dihydroquinoxaline-1-carbonyl]benzonitrile CAS Name: 3-[oxo-[3-oxo-6-(trifluoromethyl)-2,4-dihydroquinoxalin-1-yl]methyl]benzonitrile IUPAC Name: 3-[3-oxo-6-(trifluoromethyl)-2,4-dihydroquinoxaline-1-carbonyl]benzonitrile Traditional Name: 3-[3-keto-6-(trifluoromethyl)-2,4-dihydroquinoxaline-1-carbonyl]benzonitrile Formula: C17H10F3N3O2 MolecularWeight: 345.27541

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(N1C(=O)C3=CC=CC(=C3)C#N)C=CC(=C2)C(F)(F)F

Isomeric SMILES

C1C(=O)NC2=C(N1C(=O)C3=CC=CC(=C3)C#N)C=CC(=C2)C(F)(F)F

InChI

InChI=1S/C17H10F3N3O2/c18-17(19,20)12-4-5-14-13(7-12)22-15(24)9-23(14)16(25)11-3-1-2-10(6-11)8-21/h1-7H,9H2,(H,22,24)