ethyl 3-[(4-fluorophenyl)amino]-6-(trifluoromethyl)quinoxaline-2-carboxylate

Systemtic Name: ethyl 3-[(4-fluorophenyl)amino]-6-(trifluoromethyl)quinoxaline-2-carboxylate Openeye Name: ethyl 3-(4-fluoroanilino)-6-(trifluoromethyl)quinoxaline-2-carboxylate CAS Name: 3-(4-fluoroanilino)-6-(trifluoromethyl)-2-quinoxalinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-fluoroanilino)-6-(trifluoromethyl)quinoxaline-2-carboxylate Traditional Name: 3-(4-fluoroanilino)-6-(trifluoromethyl)quinoxaline-2-carboxylic acid ethyl ester Formula: C18H13F4N3O2 MolecularWeight: 379.308333

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC2=C(C=C(C=C2)C(F)(F)F)N=C1NC3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1=NC2=C(C=C(C=C2)C(F)(F)F)N=C1NC3=CC=C(C=C3)F

InChI

InChI=1S/C18H13F4N3O2/c1-2-27-17(26)15-16(23-12-6-4-11(19)5-7-12)25-14-9-10(18(20,21)22)3-8-13(14)24-15/h3-9H,2H2,1H3,(H,23,25)