5-[4-(2-methylpropyl)phenyl]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[4-(2-methylpropyl)phenyl]-5-oxidanylidene-pentanoic acid Openeye Name: 5-(4-isobutylphenyl)-5-oxo-pentanoic acid CAS Name: 5-[4-(2-methylpropyl)phenyl]-5-oxopentanoic acid IUPAC Name: 5-[4-(2-methylpropyl)phenyl]-5-oxopentanoic acid Traditional Name: 5-(4-isobutylphenyl)-5-keto-valeric acid Formula: C15H20O3 MolecularWeight: 248.3175

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20O3/c1-11(2)10-12-6-8-13(9-7-12)14(16)4-3-5-15(17)18/h6-9,11H,3-5,10H2,1-2H3,(H,17,18)