ethyl 7-chloranyl-2-(2-cyclopropylethynyl)-3-oxidanylidene-2-(trifluoromethyl)-4H-quinoxaline-1-carboxylate

Systemtic Name: ethyl 7-chloranyl-2-(2-cyclopropylethynyl)-3-oxidanylidene-2-(trifluoromethyl)-4H-quinoxaline-1-carboxylate Openeye Name: ethyl 7-chloro-2-(2-cyclopropylethynyl)-3-oxo-2-(trifluoromethyl)-4H-quinoxaline-1-carboxylate CAS Name: 7-chloro-2-(2-cyclopropylethynyl)-3-oxo-2-(trifluoromethyl)-4H-quinoxaline-1-carboxylic acid ethyl ester IUPAC Name: ethyl 7-chloro-2-(2-cyclopropylethynyl)-3-oxo-2-(trifluoromethyl)-4H-quinoxaline-1-carboxylate Traditional Name: 7-chloro-2-(2-cyclopropylethynyl)-3-keto-2-(trifluoromethyl)-4H-quinoxaline-1-carboxylic acid ethyl ester Formula: C17H14ClF3N2O3 MolecularWeight: 386.75287

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C2=C(C=CC(=C2)Cl)NC(=O)C1(C#CC3CC3)C(F)(F)F

Isomeric SMILES

CCOC(=O)N1C2=C(C=CC(=C2)Cl)NC(=O)C1(C#CC3CC3)C(F)(F)F

InChI

InChI=1S/C17H14ClF3N2O3/c1-2-26-15(25)23-13-9-11(18)5-6-12(13)22-14(24)16(23,17(19,20)21)8-7-10-3-4-10/h5-6,9-10H,2-4H2,1H3,(H,22,24)