4-methyl-2-[2-methyl-6-(trifluoromethyl)pyridin-3-yl]carbonyl-3-oxidanyl-cyclohepta-2,4-dien-1-one

Systemtic Name: 4-methyl-2-[2-methyl-6-(trifluoromethyl)pyridin-3-yl]carbonyl-3-oxidanyl-cyclohepta-2,4-dien-1-one Openeye Name: 3-hydroxy-4-methyl-2-[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]cyclohepta-2,4-dien-1-one CAS Name: 3-hydroxy-4-methyl-2-[[2-methyl-6-(trifluoromethyl)-3-pyridinyl]-oxomethyl]-1-cyclohepta-2,4-dienone IUPAC Name: 3-hydroxy-4-methyl-2-[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]cyclohepta-2,4-dien-1-one Traditional Name: 3-hydroxy-4-methyl-2-[2-methyl-6-(trifluoromethyl)nicotinoyl]cyclohepta-2,4-dien-1-one Formula: C16H14F3NO3 MolecularWeight: 325.28247

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCCC(=O)C(=C1O)C(=O)C2=C(N=C(C=C2)C(F)(F)F)C

Isomeric SMILES

CC1=CCCC(=O)C(=C1O)C(=O)C2=C(N=C(C=C2)C(F)(F)F)C

InChI

InChI=1S/C16H14F3NO3/c1-8-4-3-5-11(21)13(14(8)22)15(23)10-6-7-12(16(17,18)19)20-9(10)2/h4,6-7,22H,3,5H2,1-2H3