5-oxidanylidene-5-[4-(trifluoromethyl)phenyl]pentanoic acid

Systemtic Name: 5-oxidanylidene-5-[4-(trifluoromethyl)phenyl]pentanoic acid Openeye Name: 5-oxo-5-[4-(trifluoromethyl)phenyl]pentanoic acid CAS Name: 5-oxo-5-[4-(trifluoromethyl)phenyl]pentanoic acid IUPAC Name: 5-oxo-5-[4-(trifluoromethyl)phenyl]pentanoic acid Traditional Name: 5-keto-5-[4-(trifluoromethyl)phenyl]valeric acid Formula: C12H11F3O3 MolecularWeight: 260.20915

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CCCC(=O)O)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)CCCC(=O)O)C(F)(F)F

InChI

InChI=1S/C12H11F3O3/c13-12(14,15)9-6-4-8(5-7-9)10(16)2-1-3-11(17)18/h4-7H,1-3H2,(H,17,18)