2,9-di(anthracen-9-yl)-4,7-diphenyl-1,10-phenanthroline

Systemtic Name: 2,9-di(anthracen-9-yl)-4,7-diphenyl-1,10-phenanthroline Openeye Name: 2,9-bis(9-anthryl)-4,7-diphenyl-1,10-phenanthroline CAS Name: 2,9-bis(9-anthracenyl)-4,7-diphenyl-1,10-phenanthroline IUPAC Name: 2,9-di(anthracen-9-yl)-4,7-diphenyl-1,10-phenanthroline Traditional Name: 2,9-bis(9-anthryl)-4,7-diphenyl-1,10-phenanthroline Formula: C52H32N2 MolecularWeight: 684.82388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NC3=C2C=CC4=C3N=C(C=C4C5=CC=CC=C5)C6=C7C=CC=CC7=CC8=CC=CC=C86)C9=C1C=CC=CC1=CC1=CC=CC=C19

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NC3=C2C=CC4=C3N=C(C=C4C5=CC=CC=C5)C6=C7C=CC=CC7=CC8=CC=CC=C86)C9=C1C=CC=CC1=CC1=CC=CC=C19

InChI

InChI=1S/C52H32N2/c1-3-15-33(16-4-1)45-31-47(49-39-23-11-7-19-35(39)29-36-20-8-12-24-40(36)49)53-51-43(45)27-28-44-46(34-17-5-2-6-18-34)32-48(54-52(44)51)50-41-25-13-9-21-37(41)30-38-22-10-14-26-42(38)50/h1-32H