6-chloranyl-3-(2-cyclopropylethynyl)-4-(2-methylpropyl)-3-(trifluoromethyl)-1H-quinoxalin-2-one

Systemtic Name: 6-chloranyl-3-(2-cyclopropylethynyl)-4-(2-methylpropyl)-3-(trifluoromethyl)-1H-quinoxalin-2-one Openeye Name: 6-chloro-3-(2-cyclopropylethynyl)-4-isobutyl-3-(trifluoromethyl)-1H-quinoxalin-2-one CAS Name: 6-chloro-3-(2-cyclopropylethynyl)-4-(2-methylpropyl)-3-(trifluoromethyl)-1H-quinoxalin-2-one IUPAC Name: 6-chloro-3-(2-cyclopropylethynyl)-4-(2-methylpropyl)-3-(trifluoromethyl)-1H-quinoxalin-2-one Traditional Name: 6-chloro-3-(2-cyclopropylethynyl)-4-isobutyl-3-(trifluoromethyl)-1H-quinoxalin-2-one Formula: C18H18ClF3N2O MolecularWeight: 370.79653

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(C=CC(=C2)Cl)NC(=O)C1(C#CC3CC3)C(F)(F)F

Isomeric SMILES

CC(C)CN1C2=C(C=CC(=C2)Cl)NC(=O)C1(C#CC3CC3)C(F)(F)F

InChI

InChI=1S/C18H18ClF3N2O/c1-11(2)10-24-15-9-13(19)5-6-14(15)23-16(25)17(24,18(20,21)22)8-7-12-3-4-12/h5-6,9,11-12H,3-4,10H2,1-2H3,(H,23,25)