3,4-dicarboxy-2-(2-sulfophenyl)benzenesulfonate

Systemtic Name: 3,4-dicarboxy-2-(2-sulfophenyl)benzenesulfonate Openeye Name: 3,4-dicarboxy-2-(2-sulfophenyl)benzenesulfonate CAS Name: 3,4-dicarboxy-2-(2-sulfophenyl)benzenesulfonate IUPAC Name: 3,4-dicarboxy-2-(2-sulfophenyl)benzenesulfonate Traditional Name: 3,4-dicarboxy-2-(2-sulfophenyl)besylate Formula: C14H9O10S2- MolecularWeight: 401.34526

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=C(C=CC(=C2C(=O)O)C(=O)O)S(=O)(=O)[O-])S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C2=C(C=CC(=C2C(=O)O)C(=O)O)S(=O)(=O)[O-])S(=O)(=O)O

InChI

InChI=1S/C14H10O10S2/c15-13(16)8-5-6-10(26(22,23)24)11(12(8)14(17)18)7-3-1-2-4-9(7)25(19,20)21/h1-6H,(H,15,16)(H,17,18)(H,19,20,21)(H,22,23,24)/p-1