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

Systemtic Name: methyl 2-(2-cyclopropylethynyl)-3-oxidanylidene-2-(trifluoromethyl)-4H-quinoxaline-1-carboxylate Openeye Name: methyl 2-(2-cyclopropylethynyl)-3-oxo-2-(trifluoromethyl)-4H-quinoxaline-1-carboxylate CAS Name: 2-(2-cyclopropylethynyl)-3-oxo-2-(trifluoromethyl)-4H-quinoxaline-1-carboxylic acid methyl ester IUPAC Name: methyl 2-(2-cyclopropylethynyl)-3-oxo-2-(trifluoromethyl)-4H-quinoxaline-1-carboxylate Traditional Name: 2-(2-cyclopropylethynyl)-3-keto-2-(trifluoromethyl)-4H-quinoxaline-1-carboxylic acid methyl ester Formula: C16H13F3N2O3 MolecularWeight: 338.28123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13F3N2O3/c1-24-14(23)21-12-5-3-2-4-11(12)20-13(22)15(21,16(17,18)19)9-8-10-6-7-10/h2-5,10H,6-7H2,1H3,(H,20,22)