2-hexyl-4-oxidanyl-benzoate

Systemtic Name: 2-hexyl-4-oxidanyl-benzoate Openeye Name: 2-hexyl-4-hydroxy-benzoate CAS Name: 2-hexyl-4-hydroxybenzoate IUPAC Name: 2-hexyl-4-hydroxybenzoate Traditional Name: 2-hexyl-4-hydroxy-benzoate Formula: C13H17O3- MolecularWeight: 221.27228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=CC(=C1)O)C(=O)[O-]

Isomeric SMILES

CCCCCCC1=C(C=CC(=C1)O)C(=O)[O-]

InChI

InChI=1S/C13H18O3/c1-2-3-4-5-6-10-9-11(14)7-8-12(10)13(15)16/h7-9,14H,2-6H2,1H3,(H,15,16)/p-1