N-(3-chlorophenyl)-3-[3-oxidanylidene-4-prop-2-enyl-7-(trifluoromethyl)quinoxalin-2-yl]propanamide

Systemtic Name: N-(3-chlorophenyl)-3-[3-oxidanylidene-4-prop-2-enyl-7-(trifluoromethyl)quinoxalin-2-yl]propanamide Openeye Name: 3-[4-allyl-3-oxo-7-(trifluoromethyl)quinoxalin-2-yl]-N-(3-chlorophenyl)propanamide CAS Name: N-(3-chlorophenyl)-3-[3-oxo-4-prop-2-enyl-7-(trifluoromethyl)-2-quinoxalinyl]propanamide IUPAC Name: N-(3-chlorophenyl)-3-[3-oxo-4-prop-2-enyl-7-(trifluoromethyl)quinoxalin-2-yl]propanamide Traditional Name: 3-[4-allyl-3-keto-7-(trifluoromethyl)quinoxalin-2-yl]-N-(3-chlorophenyl)propionamide Formula: C21H17ClF3N3O2 MolecularWeight: 435.82679

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=C(C=C(C=C2)C(F)(F)F)N=C(C1=O)CCC(=O)NC3=CC(=CC=C3)Cl

Isomeric SMILES

C=CCN1C2=C(C=C(C=C2)C(F)(F)F)N=C(C1=O)CCC(=O)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H17ClF3N3O2/c1-2-10-28-18-8-6-13(21(23,24)25)11-17(18)27-16(20(28)30)7-9-19(29)26-15-5-3-4-14(22)12-15/h2-6,8,11-12H,1,7,9-10H2,(H,26,29)