N-(2,5-dimethylphenyl)-2-[2-oxidanylidene-3-(trifluoromethyl)quinoxalin-1-yl]butanamide

Systemtic Name: N-(2,5-dimethylphenyl)-2-[2-oxidanylidene-3-(trifluoromethyl)quinoxalin-1-yl]butanamide Openeye Name: N-(2,5-dimethylphenyl)-2-[2-oxo-3-(trifluoromethyl)quinoxalin-1-yl]butanamide CAS Name: N-(2,5-dimethylphenyl)-2-[2-oxo-3-(trifluoromethyl)-1-quinoxalinyl]butanamide IUPAC Name: N-(2,5-dimethylphenyl)-2-[2-oxo-3-(trifluoromethyl)quinoxalin-1-yl]butanamide Traditional Name: N-(2,5-dimethylphenyl)-2-[2-keto-3-(trifluoromethyl)quinoxalin-1-yl]butyramide Formula: C21H20F3N3O2 MolecularWeight: 403.39761

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=CC(=C1)C)C)N2C3=CC=CC=C3N=C(C2=O)C(F)(F)F

Isomeric SMILES

CCC(C(=O)NC1=C(C=CC(=C1)C)C)N2C3=CC=CC=C3N=C(C2=O)C(F)(F)F

InChI

InChI=1S/C21H20F3N3O2/c1-4-16(19(28)26-15-11-12(2)9-10-13(15)3)27-17-8-6-5-7-14(17)25-18(20(27)29)21(22,23)24/h5-11,16H,4H2,1-3H3,(H,26,28)