6-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carboxylic acid

Systemtic Name: 6-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carboxylic acid Openeye Name: 6-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carboxylic acid CAS Name: 6-[[3-(trifluoromethyl)phenyl]methylamino]-3-pyridinecarboxylic acid IUPAC Name: 6-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carboxylic acid Traditional Name: 6-[[3-(trifluoromethyl)benzyl]amino]nicotinic acid Formula: C14H11F3N2O2 MolecularWeight: 296.24455

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)CNC2=NC=C(C=C2)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)CNC2=NC=C(C=C2)C(=O)O

InChI

InChI=1S/C14H11F3N2O2/c15-14(16,17)11-3-1-2-9(6-11)7-18-12-5-4-10(8-19-12)13(20)21/h1-6,8H,7H2,(H,18,19)(H,20,21)