5-methyl-4-oxidanylidene-2,6-bis(trifluoromethyl)-1H-pyridine-3-carboxylic acid

Systemtic Name: 5-methyl-4-oxidanylidene-2,6-bis(trifluoromethyl)-1H-pyridine-3-carboxylic acid Openeye Name: 5-methyl-4-oxo-2,6-bis(trifluoromethyl)-1H-pyridine-3-carboxylic acid CAS Name: 5-methyl-4-oxo-2,6-bis(trifluoromethyl)-1H-pyridine-3-carboxylic acid IUPAC Name: 5-methyl-4-oxo-2,6-bis(trifluoromethyl)-1H-pyridine-3-carboxylic acid Traditional Name: 4-keto-5-methyl-2,6-bis(trifluoromethyl)-1H-pyridine-3-carboxylic acid Formula: C9H5F6NO3 MolecularWeight: 289.131319

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C(C1=O)C(=O)O)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CC1=C(NC(=C(C1=O)C(=O)O)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C9H5F6NO3/c1-2-4(17)3(7(18)19)6(9(13,14)15)16-5(2)8(10,11)12/h1H3,(H,16,17)(H,18,19)