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2-(cyanomethyl)-6-(trifluoromethyl)pyridine-3-carboxylic acid

2-(cyanomethyl)-6-(trifluoromethyl)pyridine-3-carboxylic acid

Systemtic Name:2-(cyanomethyl)-6-(trifluoromethyl)pyridine-3-carboxylic acid
Openeye Name:2-(cyanomethyl)-6-(trifluoromethyl)pyridine-3-carboxylic acid
CAS Name:2-(cyanomethyl)-6-(trifluoromethyl)-3-pyridinecarboxylic acid
IUPAC Name:2-(cyanomethyl)-6-(trifluoromethyl)pyridine-3-carboxylic acid
Traditional Name:2-(cyanomethyl)-6-(trifluoromethyl)nicotinic acid
Formula: C9H5F3N2O2
MolecularWeight: 230.14341
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC(=C1C(=O)O)CC#N)C(F)(F)F


Isomeric SMILES

C1=CC(=NC(=C1C(=O)O)CC#N)C(F)(F)F


InChI

InChI=1S/C9H5F3N2O2/c10-9(11,12)7-2-1-5(8(15)16)6(14-7)3-4-13/h1-2H,3H2,(H,15,16)


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