2-methoxy-5-(4-methoxy-2-oxidanidyl-5-sulfonato-phenyl)carbonyl-4-oxidanyl-benzenesulfonate

Systemtic Name: 2-methoxy-5-(4-methoxy-2-oxidanidyl-5-sulfonato-phenyl)carbonyl-4-oxidanyl-benzenesulfonate Openeye Name: 4-hydroxy-2-methoxy-5-(4-methoxy-2-oxido-5-sulfonato-benzoyl)benzenesulfonate CAS Name: 4-hydroxy-2-methoxy-5-[(4-methoxy-2-oxido-5-sulfonatophenyl)-oxomethyl]benzenesulfonate IUPAC Name: 4-hydroxy-2-methoxy-5-(4-methoxy-2-oxido-5-sulfonatobenzoyl)benzenesulfonate Traditional Name: 4-hydroxy-2-methoxy-5-(4-methoxy-2-oxido-5-sulfonato-benzoyl)besylate Formula: C15H11O11S2-3 MolecularWeight: 431.37124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)O)C(=O)C2=CC(=C(C=C2[O-])OC)S(=O)(=O)[O-])S(=O)(=O)[O-]

Isomeric SMILES

COC1=C(C=C(C(=C1)O)C(=O)C2=CC(=C(C=C2[O-])OC)S(=O)(=O)[O-])S(=O)(=O)[O-]

InChI

InChI=1S/C15H14O11S2/c1-25-11-5-9(16)7(3-13(11)27(19,20)21)15(18)8-4-14(28(22,23)24)12(26-2)6-10(8)17/h3-6,16-17H,1-2H3,(H,19,20,21)(H,22,23,24)/p-3