1-(2-propanoyloxyethyl)-6-propyl-5-[2-(trifluoromethyl)phenyl]-4H-pyridine-3-carboxylic acid

Systemtic Name: 1-(2-propanoyloxyethyl)-6-propyl-5-[2-(trifluoromethyl)phenyl]-4H-pyridine-3-carboxylic acid Openeye Name: 1-(2-propanoyloxyethyl)-6-propyl-5-[2-(trifluoromethyl)phenyl]-4H-pyridine-3-carboxylic acid CAS Name: 1-[2-(1-oxopropoxy)ethyl]-6-propyl-5-[2-(trifluoromethyl)phenyl]-4H-pyridine-3-carboxylic acid IUPAC Name: 1-(2-propanoyloxyethyl)-6-propyl-5-[2-(trifluoromethyl)phenyl]-4H-pyridine-3-carboxylic acid Traditional Name: 1-(2-propionyloxyethyl)-6-propyl-5-[2-(trifluoromethyl)phenyl]-4H-pyridine-3-carboxylic acid Formula: C21H24F3NO4 MolecularWeight: 411.41477

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(CC(=CN1CCOC(=O)CC)C(=O)O)C2=CC=CC=C2C(F)(F)F

Isomeric SMILES

CCCC1=C(CC(=CN1CCOC(=O)CC)C(=O)O)C2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C21H24F3NO4/c1-3-7-18-16(15-8-5-6-9-17(15)21(22,23)24)12-14(20(27)28)13-25(18)10-11-29-19(26)4-2/h5-6,8-9,13H,3-4,7,10-12H2,1-2H3,(H,27,28)