(4-oxidanylidene-2-bicyclo[3.2.1]oct-2-enyl) 6-methyl-2-(trifluoromethyl)pyridine-3-carboxylate

Systemtic Name: (4-oxidanylidene-2-bicyclo[3.2.1]oct-2-enyl) 6-methyl-2-(trifluoromethyl)pyridine-3-carboxylate Openeye Name: (4-oxo-2-bicyclo[3.2.1]oct-2-enyl) 6-methyl-2-(trifluoromethyl)pyridine-3-carboxylate CAS Name: 6-methyl-2-(trifluoromethyl)-3-pyridinecarboxylic acid (4-oxo-2-bicyclo[3.2.1]oct-2-enyl) ester IUPAC Name: (4-oxo-2-bicyclo[3.2.1]oct-2-enyl) 6-methyl-2-(trifluoromethyl)pyridine-3-carboxylate Traditional Name: 6-methyl-2-(trifluoromethyl)nicotinic acid (4-keto-2-bicyclo[3.2.1]oct-2-enyl) ester Formula: C16H14F3NO3 MolecularWeight: 325.28247

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)OC2=CC(=O)C3CCC2C3)C(F)(F)F

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)OC2=CC(=O)C3CCC2C3)C(F)(F)F

InChI

InChI=1S/C16H14F3NO3/c1-8-2-5-11(14(20-8)16(17,18)19)15(22)23-13-7-12(21)9-3-4-10(13)6-9/h2,5,7,9-10H,3-4,6H2,1H3