2-[[2-oxidanylidene-6-(trifluoromethyl)-1H-pyridin-3-yl]carbonylamino]pentanoic acid

Systemtic Name: 2-[[2-oxidanylidene-6-(trifluoromethyl)-1H-pyridin-3-yl]carbonylamino]pentanoic acid Openeye Name: 2-[[2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carbonyl]amino]pentanoic acid CAS Name: 2-[[oxo-[2-oxo-6-(trifluoromethyl)-1H-pyridin-3-yl]methyl]amino]pentanoic acid IUPAC Name: 2-[[2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carbonyl]amino]pentanoic acid Traditional Name: 2-[[2-keto-6-(trifluoromethyl)-1H-pyridine-3-carbonyl]amino]valeric acid Formula: C12H13F3N2O4 MolecularWeight: 306.23783

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)O)NC(=O)C1=CC=C(NC1=O)C(F)(F)F

Isomeric SMILES

CCCC(C(=O)O)NC(=O)C1=CC=C(NC1=O)C(F)(F)F

InChI

InChI=1S/C12H13F3N2O4/c1-2-3-7(11(20)21)16-9(18)6-4-5-8(12(13,14)15)17-10(6)19/h4-5,7H,2-3H2,1H3,(H,16,18)(H,17,19)(H,20,21)