3-oxidanylidene-3-[6-oxidanylidene-2-(propylamino)-5-(trifluoromethyl)-1H-pyridin-3-yl]propanoic acid

Systemtic Name: 3-oxidanylidene-3-[6-oxidanylidene-2-(propylamino)-5-(trifluoromethyl)-1H-pyridin-3-yl]propanoic acid Openeye Name: 3-oxo-3-[6-oxo-2-(propylamino)-5-(trifluoromethyl)-1H-pyridin-3-yl]propanoic acid CAS Name: 3-oxo-3-[6-oxo-2-(propylamino)-5-(trifluoromethyl)-1H-pyridin-3-yl]propanoic acid IUPAC Name: 3-oxo-3-[6-oxo-2-(propylamino)-5-(trifluoromethyl)-1H-pyridin-3-yl]propanoic acid Traditional Name: 3-keto-3-[6-keto-2-(propylamino)-5-(trifluoromethyl)-1H-pyridin-3-yl]propionic acid Formula: C12H13F3N2O4 MolecularWeight: 306.23783

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C(C=C(C(=O)N1)C(F)(F)F)C(=O)CC(=O)O

Isomeric SMILES

CCCNC1=C(C=C(C(=O)N1)C(F)(F)F)C(=O)CC(=O)O

InChI

InChI=1S/C12H13F3N2O4/c1-2-3-16-10-6(8(18)5-9(19)20)4-7(11(21)17-10)12(13,14)15/h4H,2-3,5H2,1H3,(H,19,20)(H2,16,17,21)