2-butyl-3-oxidanylidene-6-[2,2,2-tris(fluoranyl)ethoxy]-4H-quinoxaline-5-carboxylic acid

Systemtic Name: 2-butyl-3-oxidanylidene-6-[2,2,2-tris(fluoranyl)ethoxy]-4H-quinoxaline-5-carboxylic acid Openeye Name: 2-butyl-3-oxo-6-(2,2,2-trifluoroethoxy)-4H-quinoxaline-5-carboxylic acid CAS Name: 2-butyl-3-oxo-6-(2,2,2-trifluoroethoxy)-4H-quinoxaline-5-carboxylic acid IUPAC Name: 2-butyl-3-oxo-6-(2,2,2-trifluoroethoxy)-4H-quinoxaline-5-carboxylic acid Traditional Name: 2-butyl-3-keto-6-(2,2,2-trifluoroethoxy)-4H-quinoxaline-5-carboxylic acid Formula: C15H15F3N2O4 MolecularWeight: 344.28581

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(C(=C(C=C2)OCC(F)(F)F)C(=O)O)NC1=O

Isomeric SMILES

CCCCC1=NC2=C(C(=C(C=C2)OCC(F)(F)F)C(=O)O)NC1=O

InChI

InChI=1S/C15H15F3N2O4/c1-2-3-4-9-13(21)20-12-8(19-9)5-6-10(11(12)14(22)23)24-7-15(16,17)18/h5-6H,2-4,7H2,1H3,(H,20,21)(H,22,23)