5-[4-(5-oxidanyl-5-oxidanylidene-pentyl)phenyl]pentanoic acid

Systemtic Name: 5-[4-(5-oxidanyl-5-oxidanylidene-pentyl)phenyl]pentanoic acid Openeye Name: 5-[4-(5-hydroxy-5-oxo-pentyl)phenyl]pentanoic acid CAS Name: 5-[4-(5-hydroxy-5-oxopentyl)phenyl]pentanoic acid IUPAC Name: 5-[4-(5-hydroxy-5-oxopentyl)phenyl]pentanoic acid Traditional Name: 5-[4-(5-hydroxy-5-keto-pentyl)phenyl]valeric acid Formula: C16H22O4 MolecularWeight: 278.34348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCCC(=O)O)CCCCC(=O)O

Isomeric SMILES

C1=CC(=CC=C1CCCCC(=O)O)CCCCC(=O)O

InChI

InChI=1S/C16H22O4/c17-15(18)7-3-1-5-13-9-11-14(12-10-13)6-2-4-8-16(19)20/h9-12H,1-8H2,(H,17,18)(H,19,20)