ethyl (2R)-2-(2-cyclopropylethynyl)-3-oxidanylidene-2-(trifluoromethyl)-4H-quinoxaline-1-carboxylate

Systemtic Name: ethyl (2R)-2-(2-cyclopropylethynyl)-3-oxidanylidene-2-(trifluoromethyl)-4H-quinoxaline-1-carboxylate Openeye Name: ethyl (2R)-2-(2-cyclopropylethynyl)-3-oxo-2-(trifluoromethyl)-4H-quinoxaline-1-carboxylate CAS Name: (2R)-2-(2-cyclopropylethynyl)-3-oxo-2-(trifluoromethyl)-4H-quinoxaline-1-carboxylic acid ethyl ester IUPAC Name: ethyl (2R)-2-(2-cyclopropylethynyl)-3-oxo-2-(trifluoromethyl)-4H-quinoxaline-1-carboxylate Traditional Name: (2R)-2-(2-cyclopropylethynyl)-3-keto-2-(trifluoromethyl)-4H-quinoxaline-1-carboxylic acid ethyl ester Formula: C17H15F3N2O3 MolecularWeight: 352.30781

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C2=CC=CC=C2NC(=O)C1(C#CC3CC3)C(F)(F)F

Isomeric SMILES

CCOC(=O)N1C2=CC=CC=C2NC(=O)[C@]1(C#CC3CC3)C(F)(F)F

InChI

InChI=1S/C17H15F3N2O3/c1-2-25-15(24)22-13-6-4-3-5-12(13)21-14(23)16(22,17(18,19)20)10-9-11-7-8-11/h3-6,11H,2,7-8H2,1H3,(H,21,23)/t16-/m1/s1