5-[3,5-bis(1,10-phenanthrolin-5-yl)phenyl]-1,10-phenanthroline

Systemtic Name: 5-[3,5-bis(1,10-phenanthrolin-5-yl)phenyl]-1,10-phenanthroline Openeye Name: 5-[3,5-bis(1,10-phenanthrolin-5-yl)phenyl]-1,10-phenanthroline CAS Name: 5-[3,5-bis(1,10-phenanthrolin-5-yl)phenyl]-1,10-phenanthroline IUPAC Name: 5-[3,5-bis(1,10-phenanthrolin-5-yl)phenyl]-1,10-phenanthroline Traditional Name: 5-[3,5-bis(1,10-phenanthrolin-5-yl)phenyl]-1,10-phenanthroline Formula: C42H24N6 MolecularWeight: 612.68016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CC(=C3C=CC=NC3=C2N=C1)C4=CC(=CC(=C4)C5=C6C=CC=NC6=C7C(=C5)C=CC=N7)C8=C9C=CC=NC9=C1C(=C8)C=CC=N1

Isomeric SMILES

C1=CC2=CC(=C3C=CC=NC3=C2N=C1)C4=CC(=CC(=C4)C5=C6C=CC=NC6=C7C(=C5)C=CC=N7)C8=C9C=CC=NC9=C1C(=C8)C=CC=N1

InChI

InChI=1S/C42H24N6/c1-7-25-22-34(31-10-4-16-46-40(31)37(25)43-13-1)28-19-29(35-23-26-8-2-14-44-38(26)41-32(35)11-5-17-47-41)21-30(20-28)36-24-27-9-3-15-45-39(27)42-33(36)12-6-18-48-42/h1-24H