ethyl 3-[[4-(2-ethoxy-2-oxidanylidene-ethyl)phenyl]amino]-6-(trifluoromethyl)quinoxaline-2-carboxylate

Systemtic Name: ethyl 3-[[4-(2-ethoxy-2-oxidanylidene-ethyl)phenyl]amino]-6-(trifluoromethyl)quinoxaline-2-carboxylate Openeye Name: ethyl 3-[4-(2-ethoxy-2-oxo-ethyl)anilino]-6-(trifluoromethyl)quinoxaline-2-carboxylate CAS Name: 3-[4-(2-ethoxy-2-oxoethyl)anilino]-6-(trifluoromethyl)-2-quinoxalinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[4-(2-ethoxy-2-oxoethyl)anilino]-6-(trifluoromethyl)quinoxaline-2-carboxylate Traditional Name: 3-[4-(2-ethoxy-2-keto-ethyl)anilino]-6-(trifluoromethyl)quinoxaline-2-carboxylic acid ethyl ester Formula: C22H20F3N3O4 MolecularWeight: 447.40711

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CC=C(C=C1)NC2=NC3=C(C=CC(=C3)C(F)(F)F)N=C2C(=O)OCC

Isomeric SMILES

CCOC(=O)CC1=CC=C(C=C1)NC2=NC3=C(C=CC(=C3)C(F)(F)F)N=C2C(=O)OCC

InChI

InChI=1S/C22H20F3N3O4/c1-3-31-18(29)11-13-5-8-15(9-6-13)26-20-19(21(30)32-4-2)27-16-10-7-14(22(23,24)25)12-17(16)28-20/h5-10,12H,3-4,11H2,1-2H3,(H,26,28)