4-ethyl-3-oxidanylidene-7-(trifluoromethyl)quinoxaline-2-carboxylic acid

Systemtic Name: 4-ethyl-3-oxidanylidene-7-(trifluoromethyl)quinoxaline-2-carboxylic acid Openeye Name: 4-ethyl-3-oxo-7-(trifluoromethyl)quinoxaline-2-carboxylic acid CAS Name: 4-ethyl-3-oxo-7-(trifluoromethyl)-2-quinoxalinecarboxylic acid IUPAC Name: 4-ethyl-3-oxo-7-(trifluoromethyl)quinoxaline-2-carboxylic acid Traditional Name: 4-ethyl-3-keto-7-(trifluoromethyl)quinoxaline-2-carboxylic acid Formula: C12H9F3N2O3 MolecularWeight: 286.20667

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(F)(F)F)N=C(C1=O)C(=O)O

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(F)(F)F)N=C(C1=O)C(=O)O

InChI

InChI=1S/C12H9F3N2O3/c1-2-17-8-4-3-6(12(13,14)15)5-7(8)16-9(10(17)18)11(19)20/h3-5H,2H2,1H3,(H,19,20)