2-(dimethylamino)ethanol; 2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxylic acid

Systemtic Name: 2-(dimethylamino)ethanol; 2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxylic acid Openeye Name: 2-(dimethylamino)ethanol; 2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxylic acid CAS Name: 2-(dimethylamino)ethanol; 2-[3-(trifluoromethyl)phenoxy]-3-pyridinecarboxylic acid IUPAC Name: 2-(dimethylamino)ethanol; 2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxylic acid Traditional Name: 2-(dimethylamino)ethanol; 2-[3-(trifluoromethyl)phenoxy]nicotinic acid Formula: C17H19F3N2O4 MolecularWeight: 372.33897

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCO.C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)O)C(F)(F)F

Isomeric SMILES

CN(C)CCO.C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)O)C(F)(F)F

InChI

InChI=1S/C13H8F3NO3.C4H11NO/c14-13(15,16)8-3-1-4-9(7-8)20-11-10(12(18)19)5-2-6-17-11;1-5(2)3-4-6/h1-7H,(H,18,19);6H,3-4H2,1-2H3