2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline-4a,10b-disulfonate

Systemtic Name: 2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline-4a,10b-disulfonate Openeye Name: 2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline-4a,10b-disulfonate CAS Name: 2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline-4a,10b-disulfonate IUPAC Name: 2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline-4a,10b-disulfonate Traditional Name: 2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline-4a,10b-disulfonate Formula: C26H20N2O6S2-2 MolecularWeight: 520.5768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC3(C2(N=C(C=C3C4=CC=CC=C4)C)S(=O)(=O)[O-])S(=O)(=O)[O-])C(=C1)C5=CC=CC=C5

Isomeric SMILES

CC1=NC2=C(C=CC3(C2(N=C(C=C3C4=CC=CC=C4)C)S(=O)(=O)[O-])S(=O)(=O)[O-])C(=C1)C5=CC=CC=C5

InChI

InChI=1S/C26H22N2O6S2/c1-17-15-22(19-9-5-3-6-10-19)21-13-14-25(35(29,30)31)23(20-11-7-4-8-12-20)16-18(2)28-26(25,24(21)27-17)36(32,33)34/h3-16H,1-2H3,(H,29,30,31)(H,32,33,34)/p-2