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

Systemtic Name: 2,9-bis(1,9-dimethylfluoren-9-yl)-4,7-diphenyl-1,10-phenanthroline Openeye Name: 2,9-bis(1,9-dimethylfluoren-9-yl)-4,7-diphenyl-1,10-phenanthroline CAS Name: 2,9-bis(1,9-dimethyl-9-fluorenyl)-4,7-diphenyl-1,10-phenanthroline IUPAC Name: 2,9-bis(1,9-dimethylfluoren-9-yl)-4,7-diphenyl-1,10-phenanthroline Traditional Name: 2,9-bis(1,9-dimethylfluoren-9-yl)-4,7-diphenyl-1,10-phenanthroline Formula: C54H40N2 MolecularWeight: 716.9088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1C(C3=CC=CC=C23)(C)C4=NC5=C(C=CC6=C5N=C(C=C6C7=CC=CC=C7)C8(C9=CC=CC=C9C1=C8C(=CC=C1)C)C)C(=C4)C1=CC=CC=C1

Isomeric SMILES

CC1=CC=CC2=C1C(C3=CC=CC=C23)(C)C4=NC5=C(C=CC6=C5N=C(C=C6C7=CC=CC=C7)C8(C9=CC=CC=C9C1=C8C(=CC=C1)C)C)C(=C4)C1=CC=CC=C1

InChI

InChI=1S/C54H40N2/c1-33-17-15-25-39-37-23-11-13-27-45(37)53(3,49(33)39)47-31-43(35-19-7-5-8-20-35)41-29-30-42-44(36-21-9-6-10-22-36)32-48(56-52(42)51(41)55-47)54(4)46-28-14-12-24-38(46)40-26-16-18-34(2)50(40)54/h5-32H,1-4H3