4-methoxy-N-(2-methylquinolin-4-yl)pyridine-3-carboxamide; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 4-methoxy-N-(2-methylquinolin-4-yl)pyridine-3-carboxamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 4-methoxy-N-(2-methyl-4-quinolyl)pyridine-3-carboxamide; 2,2,2-trifluoroacetic acid CAS Name: 4-methoxy-N-(2-methyl-4-quinolinyl)-3-pyridinecarboxamide; 2,2,2-trifluoroacetic acid IUPAC Name: 4-methoxy-N-(2-methylquinolin-4-yl)pyridine-3-carboxamide; 2,2,2-trifluoroacetic acid Traditional Name: 4-methoxy-N-(2-methyl-4-quinolyl)nicotinamide; 2,2,2-trifluoroacetic acid Formula: C23H18F9N3O8 MolecularWeight: 635.389949

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)NC(=O)C3=C(C=CN=C3)OC.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)NC(=O)C3=C(C=CN=C3)OC.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C17H15N3O2.3C2HF3O2/c1-11-9-15(12-5-3-4-6-14(12)19-11)20-17(21)13-10-18-8-7-16(13)22-2;3*3-2(4,5)1(6)7/h3-10H,1-2H3,(H,19,20,21);3*(H,6,7)