2-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carboxylic acid

Systemtic Name: 2-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carboxylic acid Openeye Name: 2-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carboxylic acid CAS Name: 2-[[3-(trifluoromethyl)phenyl]methylamino]-3-pyridinecarboxylic acid IUPAC Name: 2-[[3-(trifluoromethyl)phenyl]methylamino]pyridine-3-carboxylic acid Traditional Name: 2-[[3-(trifluoromethyl)benzyl]amino]nicotinic acid Formula: C14H11F3N2O2 MolecularWeight: 296.24455

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)CNC2=C(C=CC=N2)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)CNC2=C(C=CC=N2)C(=O)O

InChI

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