(E)-4-[[2-methyl-6-(trifluoromethyl)pyridin-3-yl]amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[[2-methyl-6-(trifluoromethyl)pyridin-3-yl]amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[[2-methyl-6-(trifluoromethyl)-3-pyridyl]amino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[[2-methyl-6-(trifluoromethyl)-3-pyridinyl]amino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[[2-methyl-6-(trifluoromethyl)pyridin-3-yl]amino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-keto-4-[[2-methyl-6-(trifluoromethyl)-3-pyridyl]amino]but-2-enoic acid Formula: C11H9F3N2O3 MolecularWeight: 274.19597

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)C(F)(F)F)NC(=O)C=CC(=O)O

Isomeric SMILES

CC1=C(C=CC(=N1)C(F)(F)F)NC(=O)/C=C/C(=O)O

InChI

InChI=1S/C11H9F3N2O3/c1-6-7(16-9(17)4-5-10(18)19)2-3-8(15-6)11(12,13)14/h2-5H,1H3,(H,16,17)(H,18,19)/b5-4+