4-[4-[4-(3,6-disulfonaphthalen-1-yl)oxycarbonylphenyl]phenyl]carbonyloxynaphthalene-2,7-disulfonic acid

Systemtic Name: 4-[4-[4-(3,6-disulfonaphthalen-1-yl)oxycarbonylphenyl]phenyl]carbonyloxynaphthalene-2,7-disulfonic acid Openeye Name: 4-[4-[4-[(3,6-disulfo-1-naphthyl)oxycarbonyl]phenyl]benzoyl]oxynaphthalene-2,7-disulfonic acid CAS Name: 4-[[4-[4-[(3,6-disulfo-1-naphthalenyl)oxy-oxomethyl]phenyl]phenyl]-oxomethoxy]naphthalene-2,7-disulfonic acid IUPAC Name: 4-[4-[4-(3,6-disulfonaphthalen-1-yl)oxycarbonylphenyl]benzoyl]oxynaphthalene-2,7-disulfonic acid Traditional Name: 4-[4-[4-(3,6-disulfo-1-naphthoxy)carbonylphenyl]benzoyl]oxynaphthalene-2,7-disulfonic acid Formula: C34H22O16S4 MolecularWeight: 814.78888

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(C=C2)C(=O)OC3=C4C=CC(=CC4=CC(=C3)S(=O)(=O)O)S(=O)(=O)O)C(=O)OC5=C6C=CC(=CC6=CC(=C5)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(C=C2)C(=O)OC3=C4C=CC(=CC4=CC(=C3)S(=O)(=O)O)S(=O)(=O)O)C(=O)OC5=C6C=CC(=CC6=CC(=C5)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C34H22O16S4/c35-33(49-31-17-27(53(43,44)45)15-23-13-25(51(37,38)39)9-11-29(23)31)21-5-1-19(2-6-21)20-3-7-22(8-4-20)34(36)50-32-18-28(54(46,47)48)16-24-14-26(52(40,41)42)10-12-30(24)32/h1-18H,(H,37,38,39)(H,40,41,42)(H,43,44,45)(H,46,47,48)