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

Systemtic Name: propan-2-yl 2-(2-cyclopropylethynyl)-3-oxidanylidene-2-(trifluoromethyl)-4H-quinoxaline-1-carboxylate Openeye Name: isopropyl 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 propan-2-yl ester IUPAC Name: propan-2-yl 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 isopropyl ester Formula: C18H17F3N2O3 MolecularWeight: 366.33439

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17F3N2O3/c1-11(2)26-16(25)23-14-6-4-3-5-13(14)22-15(24)17(23,18(19,20)21)10-9-12-7-8-12/h3-6,11-12H,7-8H2,1-2H3,(H,22,24)