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

Systemtic Name: propan-2-yl 7-chloranyl-2-(2-cyclopropylethynyl)-3-oxidanylidene-2-(trifluoromethyl)-4H-quinoxaline-1-carboxylate Openeye Name: isopropyl 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 propan-2-yl ester IUPAC Name: propan-2-yl 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 isopropyl ester Formula: C18H16ClF3N2O3 MolecularWeight: 400.77945

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16ClF3N2O3/c1-10(2)27-16(26)24-14-9-12(19)5-6-13(14)23-15(25)17(24,18(20,21)22)8-7-11-3-4-11/h5-6,9-11H,3-4H2,1-2H3,(H,23,25)