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

Systemtic Name: 6-chloranyl-3-(2-cyclopropylethynyl)-4-prop-2-enyl-3-(trifluoromethyl)-1H-quinoxalin-2-one Openeye Name: 4-allyl-6-chloro-3-(2-cyclopropylethynyl)-3-(trifluoromethyl)-1H-quinoxalin-2-one CAS Name: 6-chloro-3-(2-cyclopropylethynyl)-4-prop-2-enyl-3-(trifluoromethyl)-1H-quinoxalin-2-one IUPAC Name: 6-chloro-3-(2-cyclopropylethynyl)-4-prop-2-enyl-3-(trifluoromethyl)-1H-quinoxalin-2-one Traditional Name: 4-allyl-6-chloro-3-(2-cyclopropylethynyl)-3-(trifluoromethyl)-1H-quinoxalin-2-one Formula: C17H14ClF3N2O MolecularWeight: 354.75407

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=C(C=CC(=C2)Cl)NC(=O)C1(C#CC3CC3)C(F)(F)F

Isomeric SMILES

C=CCN1C2=C(C=CC(=C2)Cl)NC(=O)C1(C#CC3CC3)C(F)(F)F

InChI

InChI=1S/C17H14ClF3N2O/c1-2-9-23-14-10-12(18)5-6-13(14)22-15(24)16(23,17(19,20)21)8-7-11-3-4-11/h2,5-6,10-11H,1,3-4,9H2,(H,22,24)