ethyl 4-(pyridin-3-ylmethylamino)-8-(trifluoromethyl)quinoline-3-carboxylate

Systemtic Name: ethyl 4-(pyridin-3-ylmethylamino)-8-(trifluoromethyl)quinoline-3-carboxylate Openeye Name: ethyl 4-(3-pyridylmethylamino)-8-(trifluoromethyl)quinoline-3-carboxylate CAS Name: 4-(3-pyridinylmethylamino)-8-(trifluoromethyl)-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(pyridin-3-ylmethylamino)-8-(trifluoromethyl)quinoline-3-carboxylate Traditional Name: 4-(3-pyridylmethylamino)-8-(trifluoromethyl)quinoline-3-carboxylic acid ethyl ester Formula: C19H16F3N3O2 MolecularWeight: 375.34445

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C(=C1NCC3=CN=CC=C3)C=CC=C2C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=CN=C2C(=C1NCC3=CN=CC=C3)C=CC=C2C(F)(F)F

InChI

InChI=1S/C19H16F3N3O2/c1-2-27-18(26)14-11-25-17-13(6-3-7-15(17)19(20,21)22)16(14)24-10-12-5-4-8-23-9-12/h3-9,11H,2,10H2,1H3,(H,24,25)