2-[2'-(1,10-phenanthrolin-2-yl)-9,9'-spirobi[fluorene]-2-yl]-1,10-phenanthroline

Systemtic Name: 2-[2'-(1,10-phenanthrolin-2-yl)-9,9'-spirobi[fluorene]-2-yl]-1,10-phenanthroline Openeye Name: 2-[2'-(1,10-phenanthrolin-2-yl)-9,9'-spirobi[fluorene]-2-yl]-1,10-phenanthroline CAS Name: 2-[2'-(1,10-phenanthrolin-2-yl)-9,9'-spirobi[fluorene]-2-yl]-1,10-phenanthroline IUPAC Name: 2-[2'-(1,10-phenanthrolin-2-yl)-9,9'-spirobi[fluorene]-2-yl]-1,10-phenanthroline Traditional Name: 2-[2'-(1,10-phenanthrolin-2-yl)-9,9'-spirobi[fluorene]-2-yl]-1,10-phenanthroline Formula: C49H28N4 MolecularWeight: 672.77342

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(C24C5=CC=CC=C5C6=C4C=C(C=C6)C7=NC8=C(C=CC9=C8N=CC=C9)C=C7)C=C(C=C3)C1=NC2=C(C=CC3=C2N=CC=C3)C=C1

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(C24C5=CC=CC=C5C6=C4C=C(C=C6)C7=NC8=C(C=CC9=C8N=CC=C9)C=C7)C=C(C=C3)C1=NC2=C(C=CC3=C2N=CC=C3)C=C1

InChI

InChI=1S/C49H28N4/c1-3-11-39-35(9-1)37-21-17-33(43-23-19-31-15-13-29-7-5-25-50-45(29)47(31)52-43)27-41(37)49(39)40-12-4-2-10-36(40)38-22-18-34(28-42(38)49)44-24-20-32-16-14-30-8-6-26-51-46(30)48(32)53-44/h1-28H