2,3-bis(1-oxidanylpropyl)benzenesulfonic acid

Systemtic Name: 2,3-bis(1-oxidanylpropyl)benzenesulfonic acid Openeye Name: 2,3-bis(1-hydroxypropyl)benzenesulfonic acid CAS Name: 2,3-bis(1-hydroxypropyl)benzenesulfonic acid IUPAC Name: 2,3-bis(1-hydroxypropyl)benzenesulfonic acid Traditional Name: 2,3-bis(1-hydroxypropyl)besylic acid Formula: C12H18O5S MolecularWeight: 274.33332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18O5S/c1-3-9(13)8-6-5-7-11(18(15,16)17)12(8)10(14)4-2/h5-7,9-10,13-14H,3-4H2,1-2H3,(H,15,16,17)