3-[7-(4-sulfonatophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonate

Systemtic Name: 3-[7-(4-sulfonatophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonate Openeye Name: 3-[7-(4-sulfonatophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonate CAS Name: 3-[7-(4-sulfonatophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonate IUPAC Name: 3-[7-(4-sulfonatophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonate Traditional Name: 3-[7-(4-sulfonatophenyl)-1,10-phenanthrolin-4-yl]besylate Formula: C24H14N2O6S2-2 MolecularWeight: 490.50776

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)[O-])C2=C3C=CC4=C(C=CN=C4C3=NC=C2)C5=CC=C(C=C5)S(=O)(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)[O-])C2=C3C=CC4=C(C=CN=C4C3=NC=C2)C5=CC=C(C=C5)S(=O)(=O)[O-]

InChI

InChI=1S/C24H16N2O6S2/c27-33(28,29)17-6-4-15(5-7-17)19-10-12-25-23-21(19)8-9-22-20(11-13-26-24(22)23)16-2-1-3-18(14-16)34(30,31)32/h1-14H,(H,27,28,29)(H,30,31,32)/p-2