2-[2-(4-chlorophenyl)ethyl]-2-oxidanyl-4-oxidanylidene-pentanoic acid

Systemtic Name: 2-[2-(4-chlorophenyl)ethyl]-2-oxidanyl-4-oxidanylidene-pentanoic acid Openeye Name: 2-[2-(4-chlorophenyl)ethyl]-2-hydroxy-4-oxo-pentanoic acid CAS Name: 2-[2-(4-chlorophenyl)ethyl]-2-hydroxy-4-oxopentanoic acid IUPAC Name: 2-[2-(4-chlorophenyl)ethyl]-2-hydroxy-4-oxopentanoic acid Traditional Name: 2-[2-(4-chlorophenyl)ethyl]-2-hydroxy-4-keto-valeric acid Formula: C13H15ClO4 MolecularWeight: 270.7088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(CCC1=CC=C(C=C1)Cl)(C(=O)O)O

Isomeric SMILES

CC(=O)CC(CCC1=CC=C(C=C1)Cl)(C(=O)O)O

InChI

InChI=1S/C13H15ClO4/c1-9(15)8-13(18,12(16)17)7-6-10-2-4-11(14)5-3-10/h2-5,18H,6-8H2,1H3,(H,16,17)