5-(2-sulfophenoxy)benzene-1,3-dicarboxylic acid

Systemtic Name: 5-(2-sulfophenoxy)benzene-1,3-dicarboxylic acid Openeye Name: 5-(2-sulfophenoxy)benzene-1,3-dicarboxylic acid CAS Name: 5-(2-sulfophenoxy)benzene-1,3-dicarboxylic acid IUPAC Name: 5-(2-sulfophenoxy)benzene-1,3-dicarboxylic acid Traditional Name: 5-(2-sulfophenoxy)isophthalic acid Formula: C14H10O8S MolecularWeight: 338.2894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)OC2=CC(=CC(=C2)C(=O)O)C(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)OC2=CC(=CC(=C2)C(=O)O)C(=O)O)S(=O)(=O)O

InChI

InChI=1S/C14H10O8S/c15-13(16)8-5-9(14(17)18)7-10(6-8)22-11-3-1-2-4-12(11)23(19,20)21/h1-7H,(H,15,16)(H,17,18)(H,19,20,21)