3,5-bis(1-hydroxyethyloxycarbonyl)benzenesulfonic acid

Systemtic Name: 3,5-bis(1-hydroxyethyloxycarbonyl)benzenesulfonic acid Openeye Name: 3,5-bis(1-hydroxyethoxycarbonyl)benzenesulfonic acid CAS Name: 3,5-bis[1-hydroxyethoxy(oxo)methyl]benzenesulfonic acid IUPAC Name: 3,5-bis(1-hydroxyethoxycarbonyl)benzenesulfonic acid Traditional Name: 3,5-bis(1-hydroxyethoxycarbonyl)besylic acid Formula: C12H14O9S MolecularWeight: 334.29916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14O9S/c1-6(13)20-11(15)8-3-9(12(16)21-7(2)14)5-10(4-8)22(17,18)19/h3-7,13-14H,1-2H3,(H,17,18,19)