ethyl 2-azanyl-5-pyridin-4-yl-6-(trifluoromethyl)pyridine-3-carboxylate

Systemtic Name: ethyl 2-azanyl-5-pyridin-4-yl-6-(trifluoromethyl)pyridine-3-carboxylate Openeye Name: ethyl 2-amino-5-(4-pyridyl)-6-(trifluoromethyl)pyridine-3-carboxylate CAS Name: 2-amino-5-pyridin-4-yl-6-(trifluoromethyl)-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-5-pyridin-4-yl-6-(trifluoromethyl)pyridine-3-carboxylate Traditional Name: 2-amino-5-(4-pyridyl)-6-(trifluoromethyl)nicotinic acid ethyl ester Formula: C14H12F3N3O2 MolecularWeight: 311.25919

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C2=CC=NC=C2)C(F)(F)F)N

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C2=CC=NC=C2)C(F)(F)F)N

InChI

InChI=1S/C14H12F3N3O2/c1-2-22-13(21)10-7-9(8-3-5-19-6-4-8)11(14(15,16)17)20-12(10)18/h3-7H,2H2,1H3,(H2,18,20)