4-(2-hydroxyethyl)-2-sulfo-benzene-1,3-dicarboxylic acid

Systemtic Name: 4-(2-hydroxyethyl)-2-sulfo-benzene-1,3-dicarboxylic acid Openeye Name: 4-(2-hydroxyethyl)-2-sulfo-benzene-1,3-dicarboxylic acid CAS Name: 4-(2-hydroxyethyl)-2-sulfobenzene-1,3-dicarboxylic acid IUPAC Name: 4-(2-hydroxyethyl)-2-sulfobenzene-1,3-dicarboxylic acid Traditional Name: 4-(2-hydroxyethyl)-2-sulfo-isophthalic acid Formula: C10H10O8S MolecularWeight: 290.2466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1CCO)C(=O)O)S(=O)(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=C(C(=C1CCO)C(=O)O)S(=O)(=O)O)C(=O)O

InChI

InChI=1S/C10H10O8S/c11-4-3-5-1-2-6(9(12)13)8(19(16,17)18)7(5)10(14)15/h1-2,11H,3-4H2,(H,12,13)(H,14,15)(H,16,17,18)