4,7-diphenyl-2,9-bis(1,8,10-trimethylanthracen-9-yl)-1,10-phenanthroline

Systemtic Name: 4,7-diphenyl-2,9-bis(1,8,10-trimethylanthracen-9-yl)-1,10-phenanthroline Openeye Name: 4,7-diphenyl-2,9-bis(1,8,10-trimethyl-9-anthryl)-1,10-phenanthroline CAS Name: 4,7-diphenyl-2,9-bis(1,8,10-trimethyl-9-anthracenyl)-1,10-phenanthroline IUPAC Name: 4,7-diphenyl-2,9-bis(1,8,10-trimethylanthracen-9-yl)-1,10-phenanthroline Traditional Name: 4,7-diphenyl-2,9-bis(1,8,10-trimethyl-9-anthryl)-1,10-phenanthroline Formula: C58H44N2 MolecularWeight: 768.98336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C(C3=C(C(=CC=C3)C)C(=C12)C4=NC5=C(C=CC6=C5N=C(C=C6C7=CC=CC=C7)C8=C9C(=CC=CC9=C(C1=C8C(=CC=C1)C)C)C)C(=C4)C1=CC=CC=C1)C

Isomeric SMILES

CC1=CC=CC2=C(C3=C(C(=CC=C3)C)C(=C12)C4=NC5=C(C=CC6=C5N=C(C=C6C7=CC=CC=C7)C8=C9C(=CC=CC9=C(C1=C8C(=CC=C1)C)C)C)C(=C4)C1=CC=CC=C1)C

InChI

InChI=1S/C58H44N2/c1-33-17-13-25-41-37(5)42-26-14-18-34(2)52(42)55(51(33)41)49-31-47(39-21-9-7-10-22-39)45-29-30-46-48(40-23-11-8-12-24-40)32-50(60-58(46)57(45)59-49)56-53-35(3)19-15-27-43(53)38(6)44-28-16-20-36(4)54(44)56/h7-32H,1-6H3