4-[2-butyl-7-[2-(2-butyl-3-phenanthren-4-yl-1H-inden-4-yl)ethyl]-3H-inden-1-yl]phenanthrene

Systemtic Name: 4-[2-butyl-7-[2-(2-butyl-3-phenanthren-4-yl-1H-inden-4-yl)ethyl]-3H-inden-1-yl]phenanthrene Openeye Name: 4-[2-butyl-7-[2-[2-butyl-3-(4-phenanthryl)-1H-inden-4-yl]ethyl]-3H-inden-1-yl]phenanthrene CAS Name: 4-[2-butyl-7-[2-[2-butyl-3-(4-phenanthrenyl)-1H-inden-4-yl]ethyl]-3H-inden-1-yl]phenanthrene IUPAC Name: 4-[2-butyl-7-[2-(2-butyl-3-phenanthren-4-yl-1H-inden-4-yl)ethyl]-3H-inden-1-yl]phenanthrene Traditional Name: 4-[2-butyl-7-[2-[2-butyl-3-(4-phenanthryl)-1H-inden-4-yl]ethyl]-3H-inden-1-yl]phenanthrene Formula: C56H50 MolecularWeight: 722.9962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=C(C1)C=CC=C2CCC3=CC=CC4=C3C(=C(C4)CCCC)C5=CC=CC6=C5C7=CC=CC=C7C=C6)C8=CC=CC9=C8C1=CC=CC=C1C=C9

Isomeric SMILES

CCCCC1=C(C2=C(C1)C=CC=C2CCC3=CC=CC4=C3C(=C(C4)CCCC)C5=CC=CC6=C5C7=CC=CC=C7C=C6)C8=CC=CC9=C8C1=CC=CC=C1C=C9

InChI

InChI=1S/C56H50/c1-3-5-15-45-35-43-23-11-19-39(51(43)55(45)49-27-13-21-41-31-29-37-17-7-9-25-47(37)53(41)49)33-34-40-20-12-24-44-36-46(16-6-4-2)56(52(40)44)50-28-14-22-42-32-30-38-18-8-10-26-48(38)54(42)50/h7-14,17-32H,3-6,15-16,33-36H2,1-2H3