4,5-bis[[4-(phenylcarbonyl)phenyl]methoxy]benzene-1,3-disulfonate

Systemtic Name: 4,5-bis[[4-(phenylcarbonyl)phenyl]methoxy]benzene-1,3-disulfonate Openeye Name: 4,5-bis[(4-benzoylphenyl)methoxy]benzene-1,3-disulfonate CAS Name: 4,5-bis[(4-benzoylphenyl)methoxy]benzene-1,3-disulfonate IUPAC Name: 4,5-bis[(4-benzoylphenyl)methoxy]benzene-1,3-disulfonate Traditional Name: 4,5-bis[(4-benzoylbenzyl)oxy]benzene-1,3-disulfonate Formula: C34H24O10S2-2 MolecularWeight: 656.67836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)COC3=CC(=CC(=C3OCC4=CC=C(C=C4)C(=O)C5=CC=CC=C5)S(=O)(=O)[O-])S(=O)(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)COC3=CC(=CC(=C3OCC4=CC=C(C=C4)C(=O)C5=CC=CC=C5)S(=O)(=O)[O-])S(=O)(=O)[O-]

InChI

InChI=1S/C34H26O10S2/c35-32(25-7-3-1-4-8-25)27-15-11-23(12-16-27)21-43-30-19-29(45(37,38)39)20-31(46(40,41)42)34(30)44-22-24-13-17-28(18-14-24)33(36)26-9-5-2-6-10-26/h1-20H,21-22H2,(H,37,38,39)(H,40,41,42)/p-2