5-[9-[1,6-bis(bromanyl)heptyl]fluoren-9-yl]-5-octyl-cyclohexane-1,3-dione

Systemtic Name: 5-[9-[1,6-bis(bromanyl)heptyl]fluoren-9-yl]-5-octyl-cyclohexane-1,3-dione Openeye Name: 5-[9-(1,6-dibromoheptyl)fluoren-9-yl]-5-octyl-cyclohexane-1,3-dione CAS Name: 5-[9-(1,6-dibromoheptyl)-9-fluorenyl]-5-octylcyclohexane-1,3-dione IUPAC Name: 5-[9-(1,6-dibromoheptyl)fluoren-9-yl]-5-octylcyclohexane-1,3-dione Traditional Name: 5-[9-(1,6-dibromoheptyl)fluoren-9-yl]-5-octyl-cyclohexane-1,3-quinone Formula: C34H44Br2O2 MolecularWeight: 644.51996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1(CC(=O)CC(=O)C1)C2(C3=CC=CC=C3C4=CC=CC=C42)C(CCCCC(C)Br)Br

Isomeric SMILES

CCCCCCCCC1(CC(=O)CC(=O)C1)C2(C3=CC=CC=C3C4=CC=CC=C42)C(CCCCC(C)Br)Br

InChI

InChI=1S/C34H44Br2O2/c1-3-4-5-6-7-14-21-33(23-26(37)22-27(38)24-33)34(32(36)20-13-8-15-25(2)35)30-18-11-9-16-28(30)29-17-10-12-19-31(29)34/h9-12,16-19,25,32H,3-8,13-15,20-24H2,1-2H3