1-(1,2-diazocan-1-yl)-1,4-bis(9H-fluoren-9-yl)-1,2-diazocan-1-ium

Systemtic Name: 1-(1,2-diazocan-1-yl)-1,4-bis(9H-fluoren-9-yl)-1,2-diazocan-1-ium Openeye Name: 1-(diazocan-1-yl)-1,4-bis(9H-fluoren-9-yl)diazocan-1-ium CAS Name: 1-(1-diazocanyl)-1,4-bis(9H-fluoren-9-yl)diazocan-1-ium IUPAC Name: 1-(diazocan-1-yl)-1,4-bis(9H-fluoren-9-yl)diazocan-1-ium Traditional Name: 1-(diazocan-1-yl)-1,4-bis(9H-fluoren-9-yl)diazocan-1-ium Formula: C38H43N4+ MolecularWeight: 555.77482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(NCC1)[N+]2(CCCCC(CN2)C3C4=CC=CC=C4C5=CC=CC=C35)C6C7=CC=CC=C7C8=CC=CC=C68

Isomeric SMILES

C1CCCN(NCC1)[N+]2(CCCCC(CN2)C3C4=CC=CC=C4C5=CC=CC=C35)C6C7=CC=CC=C7C8=CC=CC=C68

InChI

InChI=1S/C38H43N4/c1-2-13-25-41(39-24-12-1)42(38-35-22-9-5-18-31(35)32-19-6-10-23-36(32)38)26-14-11-15-28(27-40-42)37-33-20-7-3-16-29(33)30-17-4-8-21-34(30)37/h3-10,16-23,28,37-40H,1-2,11-15,24-27H2/q+1