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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C2=CC=CC=C2C3=CC=CC=C31)C4=NC5=C(C=CC6=C5N=C(C=C6C7=CC=CC=C7)C8(C9=CC=CC=C9C1=CC=CC=C18)CC)C(=C4)C1=CC=CC=C1

Isomeric SMILES

CCC1(C2=CC=CC=C2C3=CC=CC=C31)C4=NC5=C(C=CC6=C5N=C(C=C6C7=CC=CC=C7)C8(C9=CC=CC=C9C1=CC=CC=C18)CC)C(=C4)C1=CC=CC=C1

InChI

InChI=1S/C54H40N2/c1-3-53(45-27-15-11-23-37(45)38-24-12-16-28-46(38)53)49-33-43(35-19-7-5-8-20-35)41-31-32-42-44(36-21-9-6-10-22-36)34-50(56-52(42)51(41)55-49)54(4-2)47-29-17-13-25-39(47)40-26-14-18-30-48(40)54/h5-34H,3-4H2,1-2H3