5-(4-fluoranyl-3-methyl-phenyl)-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-(4-fluoranyl-3-methyl-phenyl)-5-oxidanylidene-pentanoic acid Openeye Name: 5-(4-fluoro-3-methyl-phenyl)-5-oxo-pentanoic acid CAS Name: 5-(4-fluoro-3-methylphenyl)-5-oxopentanoic acid IUPAC Name: 5-(4-fluoro-3-methylphenyl)-5-oxopentanoic acid Traditional Name: 5-(4-fluoro-3-methyl-phenyl)-5-keto-valeric acid Formula: C12H13FO3 MolecularWeight: 224.228223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)CCCC(=O)O)F

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)CCCC(=O)O)F

InChI

InChI=1S/C12H13FO3/c1-8-7-9(5-6-10(8)13)11(14)3-2-4-12(15)16/h5-7H,2-4H2,1H3,(H,15,16)