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

Systemtic Name: ethyl 3-[(4-fluorophenyl)methylamino]-6-(trifluoromethyl)quinoxaline-2-carboxylate Openeye Name: ethyl 3-[(4-fluorophenyl)methylamino]-6-(trifluoromethyl)quinoxaline-2-carboxylate CAS Name: 3-[(4-fluorophenyl)methylamino]-6-(trifluoromethyl)-2-quinoxalinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(4-fluorophenyl)methylamino]-6-(trifluoromethyl)quinoxaline-2-carboxylate Traditional Name: 3-[(4-fluorobenzyl)amino]-6-(trifluoromethyl)quinoxaline-2-carboxylic acid ethyl ester Formula: C19H15F4N3O2 MolecularWeight: 393.334913

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC2=C(C=C(C=C2)C(F)(F)F)N=C1NCC3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1=NC2=C(C=C(C=C2)C(F)(F)F)N=C1NCC3=CC=C(C=C3)F

InChI

InChI=1S/C19H15F4N3O2/c1-2-28-18(27)16-17(24-10-11-3-6-13(20)7-4-11)26-15-9-12(19(21,22)23)5-8-14(15)25-16/h3-9H,2,10H2,1H3,(H,24,26)