5,5,5-tris(fluoranyl)-4-methyl-2-oxidanylidene-pentanoic acid

Systemtic Name: 5,5,5-tris(fluoranyl)-4-methyl-2-oxidanylidene-pentanoic acid Openeye Name: 5,5,5-trifluoro-4-methyl-2-oxo-pentanoic acid CAS Name: 5,5,5-trifluoro-4-methyl-2-oxopentanoic acid IUPAC Name: 5,5,5-trifluoro-4-methyl-2-oxopentanoic acid Traditional Name: 5,5,5-trifluoro-2-keto-4-methyl-valeric acid Formula: C6H7F3O3 MolecularWeight: 184.11319

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)C(=O)O)C(F)(F)F

Isomeric SMILES

CC(CC(=O)C(=O)O)C(F)(F)F

InChI

InChI=1S/C6H7F3O3/c1-3(6(7,8)9)2-4(10)5(11)12/h3H,2H2,1H3,(H,11,12)