5-octyl-2,3-bis(oxidanyl)benzenesulfonic acid

Systemtic Name: 5-octyl-2,3-bis(oxidanyl)benzenesulfonic acid Openeye Name: 2,3-dihydroxy-5-octyl-benzenesulfonic acid CAS Name: 2,3-dihydroxy-5-octylbenzenesulfonic acid IUPAC Name: 2,3-dihydroxy-5-octylbenzenesulfonic acid Traditional Name: 2,3-dihydroxy-5-octyl-besylic acid Formula: C14H22O5S MolecularWeight: 302.38648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC(=C(C(=C1)S(=O)(=O)O)O)O

Isomeric SMILES

CCCCCCCCC1=CC(=C(C(=C1)S(=O)(=O)O)O)O

InChI

InChI=1S/C14H22O5S/c1-2-3-4-5-6-7-8-11-9-12(15)14(16)13(10-11)20(17,18)19/h9-10,15-16H,2-8H2,1H3,(H,17,18,19)