3-(2-cyclopropylethynyl)-4-(1-iodanyl-2-methyl-propyl)-3-(trifluoromethyl)-1H-quinoxalin-2-one

Systemtic Name: 3-(2-cyclopropylethynyl)-4-(1-iodanyl-2-methyl-propyl)-3-(trifluoromethyl)-1H-quinoxalin-2-one Openeye Name: 3-(2-cyclopropylethynyl)-4-(1-iodo-2-methyl-propyl)-3-(trifluoromethyl)-1H-quinoxalin-2-one CAS Name: 3-(2-cyclopropylethynyl)-4-(1-iodo-2-methylpropyl)-3-(trifluoromethyl)-1H-quinoxalin-2-one IUPAC Name: 3-(2-cyclopropylethynyl)-4-(1-iodo-2-methylpropyl)-3-(trifluoromethyl)-1H-quinoxalin-2-one Traditional Name: 3-(2-cyclopropylethynyl)-4-(1-iodo-2-methyl-propyl)-3-(trifluoromethyl)-1H-quinoxalin-2-one Formula: C18H18F3IN2O MolecularWeight: 462.248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18F3IN2O/c1-11(2)15(22)24-14-6-4-3-5-13(14)23-16(25)17(24,18(19,20)21)10-9-12-7-8-12/h3-6,11-12,15H,7-8H2,1-2H3,(H,23,25)